Information card for entry 7000765

Structure parameters

• Formula: C10 H18 Au N5 O4
• Calculated formula: C10 H18 Au N5 O4
• SMILES: [Au]([n]1[nH]c(cc1C)C)[n]1[nH]c(cc1C)C.N(=O)(=O)[O-].O
• Title of publication: Non-covalent interactions at bis(pyrazole)silver(i) or -gold(i) cations
• Authors of publication: García-Pacios, Vanesa; Arroyo, Marta; Antón, Noelia; Miguel, Daniel; Villafañe, Fernando
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 12
• Pages of publication: 2135 - 2141
• a: 19.284 ± 0.004 Å
• b: 11.856 ± 0.002 Å
• c: 13.92 ± 0.003 Å
• α: 90°
• β: 102.91 ± 0.03°
• γ: 90°
• Cell volume: 3102.1 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0475
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for significantly intense reflections: 0.1181
• Weighted residual factors for all reflections included in the refinement: 0.124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No