Information card for entry 7000764

Structure parameters

• Formula: C10 H16 Au B F4 N4
• Calculated formula: C10 H16 Au B F4 N4
• SMILES: [Au]([n]1[nH]c(cc1C)C)[n]1[nH]c(cc1C)C.[B](F)(F)(F)[F-]
• 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: 7.02 ± 0.007 Å
• b: 10.416 ± 0.01 Å
• c: 20.59 ± 0.02 Å
• α: 90°
• β: 92.948 ± 0.019°
• γ: 90°
• Cell volume: 1504 ± 3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1114
• Residual factor for significantly intense reflections: 0.0979
• Weighted residual factors for significantly intense reflections: 0.2472
• Weighted residual factors for all reflections included in the refinement: 0.2523
• Goodness-of-fit parameter for all reflections included in the refinement: 1.335
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No