Information card for entry 7013559

Structure parameters

• Common name: [NPr4][Au(CN)2]*H20
• Formula: C14 H30 Au N3 O
• Calculated formula: C14 H30 Au N3 O
• SMILES: [N+](CCC)(CCC)(CCC)CCC.O.[Au](C#N)C#N
• Title of publication: Cation and hydrogen bonding effects on the self-association and luminescence of the dicyanoaurate ion, [Au(CN)2]?
• Authors of publication: Stender, Matthias; Olmstead, Marilyn M.; Balch, Alan L.; Rios, Daniel; Attar, Saeed
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 22
• Pages of publication: 4282
• a: 8.3442 ± 0.0012 Å
• b: 8.1387 ± 0.0012 Å
• c: 13.351 ± 0.002 Å
• α: 90°
• β: 95.497 ± 0.002°
• γ: 90°
• Cell volume: 902.5 ± 0.2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0475
• Residual factor for significantly intense reflections: 0.0222
• Weighted residual factors for significantly intense reflections: 0.0449
• Weighted residual factors for all reflections included in the refinement: 0.0511
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No