Information card for entry 2007195

Structure parameters

• Chemical name: 1,6-di(triphenylphosphine)-closo-decaborane
• Formula: C36 H38 B10 P2
• Calculated formula: C36 H38 B10 P2
• SMILES: [P](c1ccccc1)(c1ccccc1)(c1ccccc1)[B]123[BH]456[BH]781[BH]192[BH]234[BH]349[BH]981[B]157([P](c5ccccc5)(c5ccccc5)c5ccccc5)[BH]623[BH]491
• Title of publication: A Neutral Triphenylphosphine-Substituted <i>closo</i>-Decaborane: 1,6-(PPh~3~)~2~B~10~H~8~
• Authors of publication: Hai-Jun Yao; Chun-Hua Hu; Jian-Min Dou; Jie Sun; Jin-De Wei; Zu-En Huang; Ruo-Shui Jin; Pei-Ju Zheng
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 4
• Pages of publication: IUC9800008
• a: 10.753 ± 0.002 Å
• b: 18.955 ± 0.004 Å
• c: 10.326 ± 0.002 Å
• α: 93.87 ± 0.02°
• β: 117.92 ± 0.01°
• γ: 100.9 ± 0.02°
• Cell volume: 1796.4 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0649
• Weighted residual factors for all reflections included in the refinement: 0.1799
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No