Information card for entry 2006991

Structure parameters

• Chemical name: 1-(N-triphenylphosphinegold)-amino-anthracene-9,10-dione
• Formula: C32 H23 Au N O2 P
• Calculated formula: C32 H23 Au N O2 P
• SMILES: [Au]([P](c1ccccc1)(c1ccccc1)c1ccccc1)Nc1cccc2C(=O)c3ccccc3C(=O)c12
• Title of publication: (9,10-Dioxo-9,10-dihydro-1-anthrylaminato-<i>N</i>)(triphenylphosphine-<i>P</i>)gold
• Authors of publication: Churakov, Andrei V.; Kuz'mina, Lyudmila G.; Howard, Judith A. K.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 2
• Pages of publication: 212 - 214
• a: 8.8328 ± 0.0002 Å
• b: 9.4173 ± 0.0002 Å
• c: 16.1617 ± 0.0003 Å
• α: 96.941 ± 0.001°
• β: 98.159 ± 0.001°
• γ: 101.396 ± 0.001°
• Cell volume: 1289.06 ± 0.05 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.031
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for all reflections: 0.064
• Weighted residual factors for significantly intense reflections: 0.055
• Goodness-of-fit parameter for all reflections: 1.12
• Goodness-of-fit parameter for significantly intense reflections: 1.119
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No