Information card for entry 4323787

Structure parameters

• Formula: C45 H47 Au B9 Cl2 P3
• Calculated formula: C45 H47 Au B9 Cl2 P3
• SMILES: [Au]1([P]([C]234[C]56([P]1(c1ccccc1)c1ccccc1)[BH]17[BH2]89[BH]%102[BH]2%119[BH]978[BH]761[BH]135[BH]4%102[BH]%11971)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1.C(Cl)Cl
• Title of publication: Gold(I) Complexes with the nido-Diphosphino Ligand [7,8-(Ph2P)2-7,8-C2B9H10]-. Preparation of the First Metallocarborane Complex of this Ligand. Crystal Structures of [Au{(PPh2)2C2B9H10}(PPh3)].CH2Cl2 and [Au2{(PPh2)2C2B9H10}2{(PPh2)2(CH2)3}].3Me2CO
• Authors of publication: Olga Crespo; M. Concepción Gimeno; Peter G. Jones; Antonio Laguna
• Journal of publication: Inorganic Chemistry
• Year of publication: 1996
• Journal volume: 35
• Pages of publication: 1361 - 1366
• a: 17.326 ± 0.003 Å
• b: 20.688 ± 0.003 Å
• c: 13.442 ± 0.002 Å
• α: 90°
• β: 104.71 ± 0.012°
• γ: 90°
• Cell volume: 4660.2 ± 1.3 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 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: 0.0564
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for all reflections: 0.0945
• Weighted residual factors for significantly intense reflections: 0.0745
• Goodness-of-fit parameter for all reflections: 1.093
• Goodness-of-fit parameter for significantly intense reflections: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No