Information card for entry 4300775

Structure parameters

• Formula: C14 H16 N4 O6 P2 Zn2
• Calculated formula: C14 H16 N4 O6.436 P2 Zn2
• Title of publication: Five New Zinc Phosphite Structures: Tertiary Building Blocks in the Construction of Hybrid Materials
• Authors of publication: Fan, Jian; Slebodnick, Carla; Troya, Diego; Angel, Ross; Hanson, Brian E.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Journal issue: 8
• Pages of publication: 2719 - 2727
• a: 10.8713 ± 0.0009 Å
• b: 10.1001 ± 0.0007 Å
• c: 18.2501 ± 0.0011 Å
• α: 90°
• β: 90.285 ± 0.006°
• γ: 90°
• Cell volume: 2003.9 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0656
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.0909
• Weighted residual factors for all reflections included in the refinement: 0.1001
• Goodness-of-fit parameter for all reflections included in the refinement: 0.971
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No