Information card for entry 4327409

Structure parameters

• Formula: C54 H46 Au2 O P2 S2
• Calculated formula: C54 H46 Au2 O P2 S2
• SMILES: [Au]([P](c1ccccc1)(c1ccccc1)c1ccccc1)SC(=C1c2c(c3ccccc13)cccc2)S[Au][P](c1ccccc1)(c1ccccc1)c1ccccc1.C1CCCO1
• Title of publication: (Fluoren-9-ylidene)methanedithiolato Complexes of Gold: Synthesis, Luminescence, and Charge-Transfer Adducts1
• Authors of publication: José Vicente; Pablo González-Herrero; Yolanda García-Sánchez; Peter G. Jones; Manuel Bardají
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 7516 - 7531
• a: 17.0606 ± 0.0012 Å
• b: 14.5181 ± 0.0011 Å
• c: 19.128 ± 0.0012 Å
• α: 90°
• β: 106.3 ± 0.005°
• γ: 90°
• Cell volume: 4547.3 ± 0.6 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 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: 0.0243
• Residual factor for significantly intense reflections: 0.0182
• Weighted residual factors for significantly intense reflections: 0.0426
• Weighted residual factors for all reflections included in the refinement: 0.0439
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No