Information card for entry 2006205

Structure parameters

• Chemical name: Dichloro(2,2'-dipyridylmethanediol-N,N')gold(III) Chloride
• Formula: C11 H10 Au Cl3 N2 O2
• Calculated formula: C11 H10 Au Cl3 N2 O2
• SMILES: [Au]1(Cl)(Cl)[n]2ccccc2C(O)(O)c2[n]1cccc2.[Cl-]
• Title of publication: Bis(di-2-pyridylmethanediol-<i>N</i>,<i>N</i>')palladium(II) Dichloride Tetrahydrate and Dichloro(di-2-pyridylmethanediol-<i>N</i>,<i>N</i>')gold(III) Chloride
• Authors of publication: Sommerer, Shaun O.; Jircitano, Alan J.; Westcott, Barry L.; Abboud, Khalil A.; Bauer, Jeanette A. Krause
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 6
• Pages of publication: 707 - 710
• a: 9.233 ± 0.002 Å
• b: 12.271 ± 0.003 Å
• c: 12.627 ± 0.003 Å
• α: 90°
• β: 95.58 ± 0.03°
• γ: 90°
• Cell volume: 1423.8 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.046
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for all reflections: 0.0938
• Weighted residual factors for significantly intense reflections: 0.0898
• Goodness-of-fit parameter for all reflections: 1.008
• Goodness-of-fit parameter for significantly intense reflections: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No