Information card for entry 8106437

Structure parameters

• Formula: C52 H108 B20 Cl2 P4 Zn2
• Calculated formula: C52 H108 B20 Cl2 P4 Zn2
• Title of publication: Crystal structure of di-μ-chlorido-bis[1,2-bis(dicyclohexylphosphino)-1,2-dicarba-closo-dodecaborane-κ2P,P′]zinc(II), C52H108B20Cl2P4Zn2
• Authors of publication: Xin, Wang; Liguo, Yang; Qianqian, Gao; Yuqiang, Dai
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 1
• Pages of publication: 75 - 77
• a: 31.783 ± 0.003 Å
• b: 10.078 ± 0.001 Å
• c: 24.9326 ± 0.0019 Å
• α: 90°
• β: 109.901 ± 0.002°
• γ: 90°
• Cell volume: 7509.2 ± 1.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1474
• Residual factor for significantly intense reflections: 0.0569
• Weighted residual factors for significantly intense reflections: 0.0876
• Weighted residual factors for all reflections included in the refinement: 0.0972
• Goodness-of-fit parameter for all reflections included in the refinement: 0.89
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No