cMOF Evidence Base

Synthesis evidence

Is iron unique in promoting electrical conductivity in MOFs?

Sun L., Hendon C.H., Park S.S. et al. · Chemical Science · 2017 · 4450-4457

20 structured synthesis routes

Completeness describes how fully the route could be reconstructed from the main article and supporting information.

Partial recipeSource: SI

Route 1: Unknown

S13 · Cd(1,2,3-triazolate)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursors1,2,3-triazole; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
Linker1,2,3-triazole; initial synthesis not detailed hereNot specifiedS13 · Cd(1,2,3-triazolate)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS13 · Cd(1,2,3-triazolate)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS13 · Cd(1,2,3-triazolate)2
Partial recipeSource: SI

Route 2: Unknown

S11 · Co2Cl2(BTDD)(DMF)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH2BTDD; initial synthesis not detailed here for this analogue
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH2BTDD; initial synthesis not detailed here for this analogueNot specifiedS11 · Co2Cl2(BTDD)(DMF)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS11 · Co2Cl2(BTDD)(DMF)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS11 · Co2Cl2(BTDD)(DMF)2
Partial recipeSource: SI

Route 3: Unknown

S9 · Co2(DOBDC)(DMF)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH4DOBDC; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH4DOBDC; initial synthesis not detailed hereNot specifiedS9 · Co2(DOBDC)(DMF)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS9 · Co2(DOBDC)(DMF)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS9 · Co2(DOBDC)(DMF)2
Partial recipeSource: SI

Route 4: Unknown

S12 · Co(1,2,3-triazolate)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursors1,2,3-triazole; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
Linker1,2,3-triazole; initial synthesis not detailed hereNot specifiedS12 · Co(1,2,3-triazolate)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS12 · Co(1,2,3-triazolate)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS12 · Co(1,2,3-triazolate)2
Partial recipeSource: SI

Route 5: Unknown

S9 · Cu2(DOBDC)(DMF)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH4DOBDC; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH4DOBDC; initial synthesis not detailed hereNot specifiedS9 · Cu2(DOBDC)(DMF)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS9 · Cu2(DOBDC)(DMF)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS9 · Cu2(DOBDC)(DMF)2
Partial recipeSource: SI

Route 6: Unknown

S12 · Cu(1,2,3-triazolate)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursors1,2,3-triazole; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
Linker1,2,3-triazole; initial synthesis not detailed hereNot specifiedS12 · Cu(1,2,3-triazolate)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS12 · Cu(1,2,3-triazolate)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS12 · Cu(1,2,3-triazolate)2
Complete recipeSource: Both

Route 7: Solvothermal

S10 · Fe2Cl2(BTDD)(DMF)2

Metal precursorsanhydrous FeCl2, 48.0 mg (0.38 mmol)
Linker precursorsH2BTDD, 50.0 mg (0.19 mmol)
SolventsEtOH 50 mL; concentrated HCl 1.5 mL; DMF 50 mL; dry/de-gassed DMF and DCM for post-synthetic soaking
Additivesconcentrated HCl
AtmosphereN2-filled glovebox loading, Ar flushing and cannula transfer; rigorously air-free
Temperature130 for dissolving H2BTDD in DMF; 65 for crystallisation; 100 for activation
Time96-120 h crystallisation; 2 h activation
Substrate orientationnot applicable
Oxidant / reductantanhydrous FeCl2 acts as Fe2+ source; O2 excluded to prevent oxidation
Work-upyellow precipitate vacuum-filtered under Ar, washed with degassed DMF and MeOH, briefly dried under vacuum; then soaked in dry/de-gassed DMF three times and DCM three times
Activationevacuated under vacuum at 100 deg C for 2 h; transferred/stored in N2-filled glovebox
Scalability contextreported as 100 mL Schlenk-flask batch; no scale-up reported
Show 7 structured reagent records
RoleReagentAmount / concentrationSource
Metal Sourceanhydrous FeCl248.0 mg (0.38 mmol)S10 · Fe2Cl2(BTDD)(DMF)2
LinkerH2BTDD50.0 mg (0.19 mmol)S10 · Fe2Cl2(BTDD)(DMF)2
SolventEtOH50 mLS10 · Fe2Cl2(BTDD)(DMF)2
Acidconcentrated HCl1.5 mL · concentratedS10 · Fe2Cl2(BTDD)(DMF)2
SolventDMF50 mL for linker solution; 10 mL x 3 for soakingS10 · Fe2Cl2(BTDD)(DMF)2
SolventDCM10 mL x 3 for soakingS10 · Fe2Cl2(BTDD)(DMF)2
SolventMeOHwash solventS10 · Fe2Cl2(BTDD)(DMF)2
Partial recipeSource: Both

Route 8: Unknown

S1 · Materials

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH4DOBDC; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH4DOBDC; initial synthesis not detailed hereNot specifiedS1 · Materials
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS1 · Materials
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS1 · Materials
Partial recipeSource: Both

Route 9: Unknown

S1 · Materials

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH4DSBDC; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH4DSBDC; initial synthesis not detailed hereNot specifiedS1 · Materials
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS1 · Materials
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS1 · Materials
Partial recipeSource: SI

Route 10: Unknown

S12 · Fe(1,2,3-triazolate)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursors1,2,3-triazole; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
Linker1,2,3-triazole; initial synthesis not detailed hereNot specifiedS12 · Fe(1,2,3-triazolate)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS12 · Fe(1,2,3-triazolate)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS12 · Fe(1,2,3-triazolate)2
Partial recipeSource: SI

Route 11: Unknown

S8-S9 · Mg2(DOBDC)(DMF)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH4DOBDC; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH4DOBDC; initial synthesis not detailed hereNot specifiedS8-S9 · Mg2(DOBDC)(DMF)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS8-S9 · Mg2(DOBDC)(DMF)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS8-S9 · Mg2(DOBDC)(DMF)2
Partial recipeSource: SI

Route 12: Unknown

S11 · Mg(1,2,3-triazolate)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursors1,2,3-triazole; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
Linker1,2,3-triazole; initial synthesis not detailed hereNot specifiedS11 · Mg(1,2,3-triazolate)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS11 · Mg(1,2,3-triazolate)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS11 · Mg(1,2,3-triazolate)2
Partial recipeSource: SI

Route 13: Unknown

S10 · Mn2Cl2(BTDD)(DMF)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH2BTDD; initial synthesis not detailed here for this analogue
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH2BTDD; initial synthesis not detailed here for this analogueNot specifiedS10 · Mn2Cl2(BTDD)(DMF)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS10 · Mn2Cl2(BTDD)(DMF)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS10 · Mn2Cl2(BTDD)(DMF)2
Partial recipeSource: Both

Route 14: Unknown

S1 · Materials

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH4DOBDC; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH4DOBDC; initial synthesis not detailed hereNot specifiedS1 · Materials
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS1 · Materials
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS1 · Materials
Partial recipeSource: Both

Route 15: Unknown

S1 · Materials

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH4DSBDC; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH4DSBDC; initial synthesis not detailed hereNot specifiedS1 · Materials
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS1 · Materials
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS1 · Materials
Partial recipeSource: SI

Route 16: Unknown

S11-S12 · Mn(1,2,3-triazolate)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursors1,2,3-triazole; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
Linker1,2,3-triazole; initial synthesis not detailed hereNot specifiedS11-S12 · Mn(1,2,3-triazolate)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS11-S12 · Mn(1,2,3-triazolate)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS11-S12 · Mn(1,2,3-triazolate)2
Partial recipeSource: SI

Route 17: Unknown

S11 · Ni2Cl2(BTDD)(DMF)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH2BTDD; initial synthesis not detailed here for this analogue
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH2BTDD; initial synthesis not detailed here for this analogueNot specifiedS11 · Ni2Cl2(BTDD)(DMF)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS11 · Ni2Cl2(BTDD)(DMF)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS11 · Ni2Cl2(BTDD)(DMF)2
Partial recipeSource: SI

Route 18: Unknown

S9 · Ni2(DOBDC)(DMF)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH4DOBDC; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH4DOBDC; initial synthesis not detailed hereNot specifiedS9 · Ni2(DOBDC)(DMF)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS9 · Ni2(DOBDC)(DMF)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS9 · Ni2(DOBDC)(DMF)2
Partial recipeSource: SI

Route 19: Unknown

S9-S10 · Zn2(DOBDC)(DMF)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursorsH4DOBDC; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
LinkerH4DOBDC; initial synthesis not detailed hereNot specifiedS9-S10 · Zn2(DOBDC)(DMF)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS9-S10 · Zn2(DOBDC)(DMF)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS9-S10 · Zn2(DOBDC)(DMF)2
Partial recipeSource: SI

Route 20: Unknown

S12-S13 · Zn(1,2,3-triazolate)2

Metal precursorsnot specified in this paper; prepared according to cited reported procedure
Linker precursors1,2,3-triazole; initial synthesis not detailed here
Solventsdry and degassed DMF, then dry and degassed DCM for activation/workup; initial synthesis solvent not specified here
Additivesnot specified for initial synthesis
Atmospheredry/de-gassed solvents; N2 glovebox used for handling air-sensitive samples; main text states Mn-, Fe-, and Co-based materials were synthesized under air-free conditions
Temperature100 for vacuum activation; initial synthesis temperature not specified here
Time2 h activation; initial synthesis time not specified here
Substrate orientationnot applicable
Oxidant / reductantnone specified
Work-upas-synthesized material soaked in 10 mL dry/de-gassed DMF three times and then 10 mL dry/de-gassed DCM three times when individually described; same treatment stated for all MOFs
Activationevacuated under vacuum at 100 deg C for 2 h; stored in N2-filled glovebox
Scalability contextpressed-pellet transport used milligram-scale powders; no scale-up assessment reported
Show 3 structured reagent records
RoleReagentAmount / concentrationSource
Linker1,2,3-triazole; initial synthesis not detailed hereNot specifiedS12-S13 · Zn(1,2,3-triazolate)2
Solventdry and degassed DMF10 mL x 3 soaks when individually describedS12-S13 · Zn(1,2,3-triazolate)2
Solventdry and degassed DCM10 mL x 3 soaks when individually describedS12-S13 · Zn(1,2,3-triazolate)2