Information card for entry 4339110

Structure parameters

• Formula: C4 H20 Co0.5 N3 O14.5 P2.5 Zr2
• Calculated formula: C4 H12.5 Co0.5 N3 O14.5 P2.5 Zr2
• Title of publication: Synthesis, structure, and photoluminescence property of a new layered zirconium phosphate |Co(dien)(2)|[Zr(4)H(8)P(5)O(26)] x 3H(2)O.
• Authors of publication: Du, Yu; Pan, Qinhe; Li, Jiyang; Yu, Jihong; Xu, Ruren
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 15
• Pages of publication: 5847 - 5851
• a: 12.1149 ± 0.0011 Å
• b: 8.8183 ± 0.0008 Å
• c: 17.3298 ± 0.0016 Å
• α: 90°
• β: 107.997 ± 0.002°
• γ: 90°
• Cell volume: 1760.8 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 7
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0838
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.0991
• Weighted residual factors for all reflections included in the refinement: 0.1097
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No