Information card for entry 7207024

Structure parameters

• Formula: C26 H26 N20 O3 Zn2
• Calculated formula: C26 H26 N20 O3 Zn2
• Title of publication: Novel tetrazole-based metal‒organic frameworks constructed from in situ synthesize bifunctional ligands: syntheses, structure and luminescent properties
• Authors of publication: Sun, Lin; Ma, Li; Cai, Jin-Biao; Liang, Li; Deng, Hong
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 3
• Pages of publication: 890
• a: 22.854 ± 0.005 Å
• b: 8.9005 ± 0.0019 Å
• c: 15.976 ± 0.003 Å
• α: 90°
• β: 108.176 ± 0.002°
• γ: 90°
• Cell volume: 3087.6 ± 1.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0352
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0692
• Weighted residual factors for all reflections included in the refinement: 0.0728
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No