Information card for entry 2014407

Structure parameters

• Chemical name: Diethyltindithiocyanatotin(IV)
• Formula: C6 H10 N2 S2 Sn
• Calculated formula: C6 H10 N2 S2 Sn
• SMILES: C(C)[Sn](CC)(N=C=S)N=C=S
• Title of publication: Dimethyl- and diethyldithiocyanatotin(IV)
• Authors of publication: Britton, Doyle
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 3
• Pages of publication: m93 - m94
• a: 14.449 ± 0.004 Å
• b: 5.5526 ± 0.0014 Å
• c: 12.66 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1015.7 ± 0.5 ų
• Cell temperature: 174 ± 2 K
• Ambient diffraction temperature: 174 ± 2 K
• Number of distinct elements: 5
• 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: 0.0147
• Residual factor for significantly intense reflections: 0.0137
• Weighted residual factors for significantly intense reflections: 0.0323
• Weighted residual factors for all reflections included in the refinement: 0.0327
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No