Information card for entry 7001054

Structure parameters

• Formula: C36 H30 Au Cl P2
• Calculated formula: C36 H30 Au Cl P2
• Title of publication: Photocrystallographic analysis of [AuCl(PPh3)2] for elucidation of the crystal packing effect on the photophysical properties
• Authors of publication: Hoshino, Manabu; Uekusa, Hidehiro; Sonoda, Shintaro; Otsuka, Takuhiro; Kaizu, Youkoh
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 16
• Pages of publication: 3085 - 3091
• a: 10.8463 ± 0.0002 Å
• b: 11.8202 ± 0.0002 Å
• c: 14.1697 ± 0.0003 Å
• α: 113.123 ± 0.0012°
• β: 95.5306 ± 0.001°
• γ: 109.578 ± 0.0011°
• Cell volume: 1518.65 ± 0.06 ų
• Cell temperature: 156 ± 2 K
• Ambient diffraction temperature: 156 ± 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 all reflections: 0.0148
• Residual factor for significantly intense reflections: 0.0146
• Weighted residual factors for significantly intense reflections: 0.0411
• Weighted residual factors for all reflections included in the refinement: 0.0412
• Goodness-of-fit parameter for all reflections included in the refinement: 1.147
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No