Information card for entry 7219738

Structure parameters

• Formula: C16 H29 N3 O17 P4 Zn2
• Calculated formula: C16 H29 N3 O17 P4 Zn2
• Title of publication: Mixed‒solvothermal synthesis, structures, surface photovoltage, luminescence and molecular recognition properties of three new transition metal phosphonates with 3D framework and supramolecular structures
• Authors of publication: Sun, Tong; Jiao, Cheng‒Qi; Li, Wen-Zhu; Sun, Zhen-Gang; Ma, Chao; Zhu, Yanyu; Ma, Ming-Xue; Luo, Hui; Zhang, Xiao-Wen; Wang, Mei-Ling
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 9.9975 ± 0.0008 Å
• b: 9.1275 ± 0.0007 Å
• c: 30.548 ± 0.003 Å
• α: 90°
• β: 97.544 ± 0.002°
• γ: 90°
• Cell volume: 2763.4 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1152
• Residual factor for significantly intense reflections: 0.0778
• Weighted residual factors for significantly intense reflections: 0.1848
• Weighted residual factors for all reflections included in the refinement: 0.2067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No