Information card for entry 7028316

Structure parameters

• Formula: C16 H14 N6 O12 V4 Zn2
• Calculated formula: C16 H14 N6 O12 V4 Zn2
• Title of publication: Syntheses, structures and properties of two 2-D layered hybrid organic-inorganic materials based on different V4O12 building units.
• Authors of publication: Hou, Wentao; Guo, Jiuyu; Xu, Xiao; Wang, Zuoxiang; Zhang, Deng; Wan, Hongxiang; Song, You; Zhu, Dunru; Xu, Yan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 2
• Pages of publication: 865 - 871
• a: 8.466 ± 0.005 Å
• b: 10.357 ± 0.006 Å
• c: 15.391 ± 0.008 Å
• α: 92.394 ± 0.007°
• β: 105.807 ± 0.007°
• γ: 112.067 ± 0.007°
• Cell volume: 1187.5 ± 1.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1019
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0505
• Weighted residual factors for all reflections included in the refinement: 0.0553
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No