Information card for entry 7208234

Structure parameters

• Formula: C8 H11 N O10 P2 Zn1.5
• Calculated formula: C8 H11 N O10 P2 Zn1.5
• Title of publication: Synthesis, structures and surface photovoltage properties of four novel metal phosphonates with a 3D supramolecular structure
• Authors of publication: Li, Chao; Jiao, Cheng-Qi; Sun, Zhen-Gang; Chen, Kai; Wang, Cheng-Lin; Zhu, Yan-Yu; Zhu, Jiang; Zhao, Yan; Zheng, Ming-Jing; Sun, Shou-Hui; Chu, Wei; Tian, Hui
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 17
• Pages of publication: 5479
• a: 8.9851 ± 0.0011 Å
• b: 9.067 ± 0.0011 Å
• c: 9.88 ± 0.002 Å
• α: 100.371 ± 0.002°
• β: 108.901 ± 0.002°
• γ: 110.549 ± 0.002°
• Cell volume: 672.71 ± 0.18 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.0519
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.1144
• Weighted residual factors for all reflections included in the refinement: 0.1212
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No