Information card for entry 2006679

Structure parameters

• Chemical name: N,N'-(dimethylthiourea)gold(I) perchlorate
• Formula: C6 H16 Au Cl N4 O4 S2
• Calculated formula: C6 H16 Au Cl N4 O4 S2
• SMILES: Cl(=O)(=O)(=O)[O-].[Au]([S]=C(NC)NC)[S]=C(NC)NC
• Title of publication: Bis(<i>N</i>,<i>N</i>'-dimethylthiourea-<i>S</i>)gold(I) Perchlorate and Bis(<i>N</i>,<i>N</i>'-diethylthiourea-<i>S</i>)gold(I) Perchlorate
• Authors of publication: Richard J. Staples; John P. Fackler Jr; Juan Costamagna
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 11
• Pages of publication: 1555 - 1558
• a: 13.8946 ± 0.0008 Å
• b: 16.513 ± 0.0001 Å
• c: 6.4276 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1474.76 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0325
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for all reflections: 0.1097
• Weighted residual factors for significantly intense reflections: 0.1096
• Goodness-of-fit parameter for all reflections: 1.252
• Goodness-of-fit parameter for significantly intense reflections: 1.255
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No