Information card for entry 7233763

Structure parameters

• Formula: C32 H20 Cu2 N8 O10
• Calculated formula: C32 H20 Cu2 N8 O10
• Title of publication: Desolvation process in the flexible metal‒organic framework [Cu(Me-4py-trz-ia)], adsorption of dihydrogen and related structure responses
• Authors of publication: Erhart, Oliver; Georgiev, Peter A.; Krautscheid, Harald
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 43
• Pages of publication: 6523
• a: 14.5493 ± 0.0003 Å
• b: 11.93948 ± 0.00014 Å
• c: 14.1517 ± 0.0003 Å
• α: 90°
• β: 93.6939 ± 0.0005°
• γ: 90°
• Cell volume: 2453.2 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Goodness-of-fit parameter for all reflections: 5.08
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.5406 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No