Information card for entry 7114703

Structure parameters

• Formula: C18 H51 B10 Ge2 Ni P2
• Calculated formula: C18 H51 B10 Ge2 Ni P2
• SMILES: [Ge]1([Ni]([Ge]([C]2345[BH]678[BH]9%10%11[BH]%12%13%14[BH]%15%169[BH]96%10[BH]627[BH]273[BH]4%12([BH]%13%152[BH]%16967)[C]158%11%14)(C)C)([P](CC)(CC)CC)[P](CC)(CC)CC)(C)C
• Title of publication: The first 1,3-digermyla-2-nickela-carboranylene and the Ni-catalyzed double germylation of unsaturated organic substrates
• Authors of publication: Lee, Junghyun; Lee, Chongchan; Kang, Sang Ook; Ko, Jaejung; Lee, Shim Sung
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 18
• Pages of publication: 1730
• a: 11.2888 ± 0.0001 Å
• b: 14.2049 ± 0.0003 Å
• c: 20.693 ± 0.0004 Å
• α: 90°
• β: 104.776 ± 0.001°
• γ: 90°
• Cell volume: 3208.52 ± 0.1 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• 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: 0.0421
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0809
• Weighted residual factors for all reflections included in the refinement: 0.0864
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No