Huang S., Yan P., Han Z. et al. · Advanced Materials · 2025 · 2502192
Open a family to keep every result attached to its sample, method and conditions.
Paraphrased for this database from the authors’ stated interpretations — never quoted verbatim — and kept separate from reported measurements.
SJTU-201 shows the best reported ENRR performance in this paper, with 87.1 +/- 1.8% NH3 FE and 56.0 +/- 1.5 ug h-1 mgcat-1 yield at -0.30 V vs RHE.
Caveat: Electrode is a MOF/carbon/Nafion composite ink; pristine powder properties are separately extracted.
10 · Electrocatalytic Activity · Figure 6; Table S6 · Linked to 2 structured results
Strong interlayer interactions in multilayer-stacked SJTUs shrink the bandgaps relative to monolayers, yielding ultra-narrow direct gaps of 0.10-0.28 eV.
Caveat: Bandgap mechanism is based on DFT calculations and local DOS rather than direct transport activation measurements.
6 · Photoconductivity · Figure 5; Figure S51 · Linked to 6 structured results
Direct coordination of aryldiisocyanide ligands with low-valent Rh(I) produces air-stable, metal-carbon coordinated 2D MOFs with Rh-C4 sites.
Caveat: Coordination assignment combines spectroscopy, XPS/EXAFS, and model compounds; no single-crystal structure of SJTUs is reported.
2 · Design and Synthesis · Figures S20-S33 · Linked to 5 structured results
In situ ATR-SEIRAS, DEMS, and DFT support dual ENRR pathways on Rh(I)-C4 sites: associative distal and two-electron transfer via N2Hx species.
Caveat: DEMS m/z assignments include possible overlaps; pathway conclusion combines experimental signatures and DFT.
10 · Electrocatalytic Activity · Figure 6e-g · Linked to 4 structured results
TRTS/Drude-Smith fitting indicates high short-range photocarrier mobilities, with SJTU-201 reaching 560 +/- 46 cm2 V-1 s-1 intrinsic mobility.
Caveat: These are photogenerated short-range TRTS mobilities; dc-limit values are much lower (9-17 cm2 V-1 s-1).
8 · TRTS · Figure 5; Table S4 · Linked to 4 structured results
Names and aliases are kept exactly within the paper’s own identity model.
| Material | Composition | Structure context | Source |
|---|---|---|---|
| model compound M1 | C36H36ClN4Rh; tetrakis(2,6-dimethylphenylisocyanide)rhodium(I) chloride hydrate in SI tablemononuclear Rh(I) tetrakis(isocyano) complex · 2,6-dimethylphenylisocyanide (iCN-A) | 0D · Model SystemSquare-planar D4h-like Rh(I) model compound characterised by SC-XRD. | 2 · Design and Synthesis · Figure 1a; Figure S11 |
| model compound M2 | C60H36ClN4Rhmononuclear Rh(I) tetrakis(isocyano) complex · 4-phenylethynyl phenyl isocyanide (iCN-B) | 0D · Model SystemMolecular Rh(I)-isocyanide model compound characterised by NMR and MALDI-TOF-MS. | 2 · Design and Synthesis · Figure 1a; Schemes S1-S2 |
| SJTU-201 | [RhI(L)2Cl]n; L = 1,4-diisocyanobenzenelow-valent Rh(I) centres with Rh-C4 isocyanide coordination sites · 1,4-diisocyanobenzene (iCN-1) | 2D · Pristine2D Rh-isocyanide MOF with quasi-square sql in-plane network and inclined AA stacking; refined a=b=11.3 A, c=3.56 A, alpha=beta=81 deg, gamma=90 deg. | 2 · Introduction |
| SJTU-202 | [RhI(L)2Cl]n; L = 4,4'-diisocyano-3,3',5,5'-tetramethyl-1,1'-biphenyllow-valent Rh(I) centres with Rh-C4 isocyanide coordination sites · 3,3',5,5'-tetramethyl-4,4'-biphenyldiisocyanide (iCN-2) | 2D · Pristine2D Rh-isocyanide MOF with quasi-square sql in-plane network and eclipsed AA stacking; refined a=b=15.8 A, c=3.55 A, alpha=beta=gamma=90 deg. | 2 · Introduction |
| SJTU-203 | [RhI(L)2Cl]n; L = 4,4'-diisocyano-1,1'-(ethynediyl)bis[benzene]low-valent Rh(I) centres with Rh-C4 isocyanide coordination sites · 4,4'-diisocyano-1,1'-(ethynediyl)bis[benzene] (iCN-3) | 2D · Pristine2D Rh-isocyanide MOF with rhombus pore packing and inclined AA stacking; refined a=b=17.9 A, c=3.59 A, alpha=beta=74 deg, gamma=90 deg. | 2 · Introduction |
Sample form, processing state and composition status define the context for measurements.
| Sample | Form and role | Processing and geometry | Source |
|---|---|---|---|
| model compound M1research_0638__mat__mat_m1 | Model · Model System · Model | molecular Rh-isocyanide complex; crystals grown from hexanes/THF at -20 C for SC-XRD | 8 · Synthesis of the model compound M1 · Scheme S1 |
| model compound M2research_0638__mat__mat_m2 | Model · Model System · Model | molecular Rh-isocyanide complex washed with methanol and hexanes | 10 · Synthesis of the model compound M2 · Scheme S2 |
| SJTU-201 catalyst ink/electrode compositeresearch_0638__mat__mat_sjtu201 | Electrode · Composite Sample · Composite | MOF and carbon black dispersed in 0.5% Nafion ethanol solution; stirred overnight and sonicatedworking electrode in H-cell; exact support not specified | 7 · Preparation of catalyst ink |
| as-prepared SJTU-201 powderresearch_0638__mat__mat_sjtu201 | Powder · Target Sample · Pristine Framework | dark green solid obtained by filtration, chloroform washing, and vacuum drying | 14 · Synthesis of 2D Rh-iCN MOFs · Scheme S6 |
| SJTU-202 catalyst ink/electrode compositeresearch_0638__mat__mat_sjtu202 | Electrode · Composite Sample · Composite | MOF and carbon black dispersed in 0.5% Nafion ethanol solution; stirred overnight and sonicatedworking electrode in H-cell; exact support not specified | 7 · Preparation of catalyst ink |
| as-prepared SJTU-202 powderresearch_0638__mat__mat_sjtu202 | Powder · Target Sample · Pristine Framework | dark green solid obtained by filtration, chloroform washing, and vacuum drying | 14 · Synthesis of 2D Rh-iCN MOFs · Scheme S6 |
| SJTU-203 catalyst ink/electrode compositeresearch_0638__mat__mat_sjtu203 | Electrode · Composite Sample · Composite | MOF and carbon black dispersed in 0.5% Nafion ethanol solution; stirred overnight and sonicatedworking electrode in H-cell; exact support not specified | 7 · Preparation of catalyst ink |
| as-prepared SJTU-203 powderresearch_0638__mat__mat_sjtu203 | Powder · Target Sample · Pristine Framework | dark green solid obtained by filtration, chloroform washing, and vacuum drying | 14 · Synthesis of 2D Rh-iCN MOFs · Scheme S6 |