Diffraction Structure — Synthesis of a copper 1,3,5-triamino-2,4,6-benzenetriol metal-organic framework

3 measurement groups · 8 results

Reported values remain attached to the sample, method, conditions, extraction quality and source location that produced them.

Iodine-doped Cu3(TABTO)2-Ar powder · Powder

Synchrotron XRD of pristine and iodine-doped Cu3(TABTO)2-Ar; X-ray energy 18.981 keV, wavelength 0.6532 Angstrom.

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
Synchrotron XRD iodine-doping phase assignment	gamma-CuI formed; Cu3(TABTO)2-Ar crystalline structure retained; I3- and CuI present in pores	—	—	Text Qualitative	S22 · Synchrotron XRD data · Figure S12

Cu3(TABTO)2-Air-1 powder · Powder

XRD comparison of Cu3(TABTO)2-Air-1 and Cu3(TABTO)2-Air-2.

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
Cu metal in Cu3(TABTO)2-Air-1	No copper metal signal appears	—	—	Qualitative Qualitative	18349 · Results and Discussion · Figure 3
Cu metal in Cu3(TABTO)2-Air-2	Copper metal formed	—	—	Qualitative Qualitative	18349 · Results and Discussion · Figure 3

Cu3(TABTO)2-Ar powder · Powder

As-obtained Cu3(TABTO)2-Ar powder compared with simulated AA' and SP stacking patterns.

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
Cu3(TABTO)2-Ar (002) XRD peak	2theta = 28.17 deg	—	—	Text Exact Reported	18347 · Results and Discussion · Figure 1b
Cu3(TABTO)2-Ar (100) XRD peak	2theta = 7.64 deg	—	—	Text Exact Reported	18347 · Results and Discussion · Figure 1b
Cu3(TABTO)2-Ar (200) XRD peak	2theta = 15.54 deg	—	—	Text Exact Reported	18347 · Results and Discussion · Figure 1b
Copper metal in Ar-synthesised sample	Cu metal peaks observed	—	—	Qualitative Qualitative	18347 · Results and Discussion · Figure 1b
Experimental interlayer distance from XRDMarked as a best value within this paper	3.17 Angstrom	—	—	Text Exact Reported	18347 · Results and Discussion · Figure 1b