Information card for entry 7000924

Structure parameters

• Formula: C6 H16 Ag2 N10 S6
• Calculated formula: C6 H16 Ag2 N10 S6
• SMILES: C(N)(N)=[S][Ag]([S]=C(N)N)SC#N
• Title of publication: 1 : 1 complexes of silver(i) thiocyanate with (substituted) thiourea ligands
• Authors of publication: Bowmaker, Graham A.; Pakawatchai, Chaveng; Saithong, Saowanit; Skelton, Brian W.; White, Allan H.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 14
• Pages of publication: 2588 - 2598
• a: 11.0271 ± 0.0004 Å
• b: 13.7937 ± 0.0006 Å
• c: 13.6913 ± 0.0008 Å
• α: 90°
• β: 111.889 ± 0.005°
• γ: 90°
• Cell volume: 1932.38 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0388
• Residual factor for significantly intense reflections: 0.0264
• Weighted residual factors for significantly intense reflections: 0.056
• Weighted residual factors for all reflections included in the refinement: 0.0579
• Goodness-of-fit parameter for all reflections included in the refinement: 0.937
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No