Porosity — Bi-porous metal-organic framework with hydrophilic and hydrophobic channels: Selective gas sorption and reversible iodine uptake studies

3 measurement groups · 13 results

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

guest-free activated compound 1' · Pellet

CO2, CH4, N2 and H2 adsorption at 273 K; CO2 heat of sorption calculated from 273 K and 298 K data.

Temperature: 273
Atmosphere: CO2, CH4, N2, H2
Geometry: activated powder
Context: guest-free activated pristine framework
Measurement source: p007; p037-p038 · Gas adsorption details; Gas Sorption Data · Fig. S6; Fig. S9; gas sorption data table

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
CH4 adsorption uptake at 273 K near 100 kPa	3.442 at P = 100.43	—	—	SI Table Exact Reported	p037 · Gas Sorption Data · Gas sorption data table
CO2 adsorption uptake at 273 K near 100 kPaMarked as a best value within this paper	12.853 at P = 100.52	—	—	SI Table Exact Reported	p037 · Gas Sorption Data · Gas sorption data table
low-loading isosteric heat of CO2 adsorptionMarked as a best value within this paper	about 25 kJ mol-1	—	—	Text Approximate	p004 / 9468 · Results and discussion · Fig. S9
N2 adsorption uptake at 273 K near 100 kPa	1.3187 at P = 100.57	—	—	SI Table Exact Reported	p038 · Gas Sorption Data · Gas sorption data table

guest-free activated compound 1' · Pellet

CO2 at 195 K; CH4 at 195 K; N2 and H2 at 77 K; gases 99.999% purity; sample degassed under vacuum before measurement.

Temperature: 195; 77
Atmosphere: gas sorption atmospheres CO2, CH4, N2, H2
Geometry: activated powder
Context: guest-free activated pristine framework
Measurement source: p007-p008; p036 · Gas adsorption details; Gas Sorption Data · Fig. S7; gas sorption data table

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
CH4 adsorption uptake at 195 K near 100 kPa	12.181 at P = 100.07	—	—	SI Table Exact Reported	p036 · Gas Sorption Data · Gas sorption data table
CO2 adsorption uptake at 195 K near 95 kPaMarked as a best value within this paper	59.352 at P = 95.18	—	—	SI Table Exact Reported	p036 · Gas Sorption Data · Gas sorption data table
H2 adsorption uptake at 77 K near 100 kPa	17.771 at P = 100.15	—	—	SI Table Exact Reported	p037 · Gas Sorption Data · Gas sorption data table
N2 adsorption uptake at 77 K near 96 kPa	6.1573 at P = 95.668	—	—	SI Table Exact Reported	p036 · Gas Sorption Data · Gas sorption data table
effective pore diameter from H-K plotMarked as a best value within this paper	0.6 nm	6 Angstrom	—	Text Rounded Reported	p004 / 9468 · Results and discussion · Fig. 4 inset; Fig. S8

as-synthesised compound 1 · Single Crystal

Channel dimensions reported from crystallographic model; void volumes reported from PLATON analysis and CIF SQUEEZE output.

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
hydrophilic channel dimensions	7.448 x 7.676	—	—	Text Exact Reported	p003 / 9467 · Results and discussion · Fig. 2; Fig. S3
hydrophobic channel dimensions	2.33 x 1.926	—	—	Text Exact Reported	p003 / 9467 · Results and discussion · Fig. 2; Fig. S3
PLATON free void fraction reported in main text	36.9%	—	—	Text Approximate	p003 / 9467 · Results and discussion
CIF SQUEEZE total potential solvent area volumeMarked as a best value within this paper	1025.8 Angstrom^3 [27.3% of cell volume]	—	—	SI Table Exact Reported	CIF lines 1080-1110 · PLATON SQUEEZE details · _platon_squeeze_details