Information card for entry 4346838

Structure parameters

• Formula: C94 H140 Cl4 Li2 Ni2 O8 P2
• Calculated formula: C93.5 H139 Cl3 Li2 Ni2 O8 P2
• Title of publication: Homo- and Heteropolynuclear Clusters of Phosphine Triphenolates.
• Authors of publication: Liang, Lan-Chang; Chou, Kuan-Wei; Su, Wei-Jia; Chen, Han-Sheng; Hsu, Yu-Lin
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 23
• Pages of publication: 11526 - 11534
• a: 14.4092 ± 0.0002 Å
• b: 27.3111 ± 0.0005 Å
• c: 26.0713 ± 0.0005 Å
• α: 90°
• β: 95.439 ± 0.001°
• γ: 90°
• Cell volume: 10213.7 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1691
• Residual factor for significantly intense reflections: 0.0965
• Weighted residual factors for significantly intense reflections: 0.2555
• Weighted residual factors for all reflections included in the refinement: 0.2924
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No