Information card for entry 7107999

Structure parameters

• Formula: C25 H30 Au N O2
• Calculated formula: C25 H30 Au N O2
• SMILES: O.[Au]12(c3cc(C(C)(C)C)ccc3c3[n]1c(ccc3)c1ccc(cc21)C(C)(C)C)O
• Title of publication: Cyclometallated gold(III) hydroxides as versatile synthons for Au-N, Au-C complexes and luminescent compounds
• Authors of publication: Dragos-Adrian Rosca; Dan A. Smith; Manfred Bochmann
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 7247
• a: 14.9668 ± 0.0004 Å
• b: 11.3514 ± 0.0003 Å
• c: 12.9152 ± 0.0004 Å
• α: 90°
• β: 99.366 ± 0.003°
• γ: 90°
• Cell volume: 2164.97 ± 0.11 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 5
• 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: 0.0277
• Residual factor for significantly intense reflections: 0.0236
• Weighted residual factors for significantly intense reflections: 0.0547
• Weighted residual factors for all reflections included in the refinement: 0.0569
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No