Information card for entry 2008411

Structure parameters

• Chemical name: 2,4-Di(triphenylphosphino)-closo-decaborane-Dichloromethane (1/1)
• Formula: C37 H40 B10 Cl2 P2
• Calculated formula: C37 H40 B10 Cl2 P2
• SMILES: [P](c1ccccc1)(c1ccccc1)(c1ccccc1)[B]1234[BH]56[BH]781[B]195([P](c5ccccc5)(c5ccccc5)(c5ccccc5))[BH]526[BH]263[BH]347[BH]481[BH]952[BH]634.C(Cl)Cl
• Title of publication: 2,4-Bis(triphenylphosphino)-<i>closo</i>-decaborane‒dichloromethane (1/1)
• Authors of publication: Yao, Hai-Jun; Hu, Chun-Hua; Dou, Jian-Min; Jin, Ruo-Shui; Zheng, Pei-Ju
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 4
• Pages of publication: IUC9900033
• a: 10.077 ± 0.004 Å
• b: 13.231 ± 0.003 Å
• c: 17.167 ± 0.004 Å
• α: 98.14 ± 0.02°
• β: 106.12 ± 0.03°
• γ: 111.12 ± 0.03°
• Cell volume: 1975.2 ± 1.2 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for all reflections included in the refinement: 0.198
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No