Information card for entry 2007019

Structure parameters

• Chemical name: μ-{7,8-Bis(diphenylphosphino)-7,8-dicarba-nido-undecaborato-P,P'}- pentafluorophenyltriphenylphosphinedigold(I) dichloromethane solvate
• Formula: C51 H47 Au2 B9 Cl2 F5 P3
• Calculated formula: C51 H47 Au2 B9 Cl2 F5 P3
• SMILES: [Au]1([Au]([P]([C]234[BH]567[BH]89%10[BH]%1125[BH]258[BH]8%129[BH]96%10[BH]%12([BH2]58[BH]3%112)[C]479[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1)c1c(c(c(c(c1F)F)F)F)F.C(Cl)Cl
• Title of publication: μ-[7,8-Bis(diphenylphosphino)-7,8-dicarba-<i>nido</i>-undecaborato-1κ<i>P</i>,2κ<i>P</i>'](pentafluorophenyl-1κ<i>C</i>)(triphenylphosphine-2κ<i>P</i>)digold(I) Dichloromethane Solvate
• Authors of publication: Crespo, Olga; Gimeno, M. Concepción; Laguna, Antonio; Villacampa, M. Dolores
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 2
• Pages of publication: 203 - 205
• a: 12.36 ± 0.002 Å
• b: 17.042 ± 0.003 Å
• c: 25.08 ± 0.005 Å
• α: 90°
• β: 92.93 ± 0.03°
• γ: 90°
• Cell volume: 5275.9 ± 1.6 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0604
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for all reflections: 0.1081
• Weighted residual factors for significantly intense reflections: 0.0987
• Goodness-of-fit parameter for all reflections: 1.04
• Goodness-of-fit parameter for significantly intense reflections: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No