Information card for entry 7125089

Structure parameters

• Formula: C26 H16 N2 O8 Zn2
• Calculated formula: C26 H16 N2 O8 Zn2
• Title of publication: Creation of new guest accessible space under gas pressure in a flexible MOF: multidimensional insight through combination of in situ techniques.
• Authors of publication: Bhatt, Prashant M.; Batisai, Eustina; Smith, Vincent J.; Barbour, Leonard J.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 76
• Pages of publication: 11374 - 11377
• a: 10.887 ± 0.005 Å
• b: 10.896 ± 0.004 Å
• c: 14.07 ± 0.006 Å
• α: 91.252 ± 0.004°
• β: 92.588 ± 0.005°
• γ: 104.43 ± 0.005°
• Cell volume: 1613.8 ± 1.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1384
• Residual factor for significantly intense reflections: 0.0862
• Weighted residual factors for significantly intense reflections: 0.2061
• Weighted residual factors for all reflections included in the refinement: 0.2228
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No