Information card for entry 7023531

Structure parameters

• Formula: C7 H15 N2 O12 P3 Zn2
• Calculated formula: C7 H15 N2 O12 P3 Zn2
• Title of publication: In situ template generation via N-alkylation in the syntheses of open-framework zinc phosphites and phosphate.
• Authors of publication: Wang, Guoming; Li, Jinhua; Zhang, Xiao; Wang, Pei; Pang, BeiBei; Wang, Zonghua; Wang, Yingxia; Lin, Jianhua; Pan, Chunyang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 36
• Pages of publication: 13084 - 13091
• a: 16.2387 ± 0.0002 Å
• b: 9.3708 ± 0.0007 Å
• c: 10.5007 ± 0.0005 Å
• α: 90°
• β: 93.898 ± 0.003°
• γ: 90°
• Cell volume: 1594.19 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0316
• Residual factor for significantly intense reflections: 0.0275
• Weighted residual factors for significantly intense reflections: 0.0705
• Weighted residual factors for all reflections included in the refinement: 0.0723
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No