Information card for entry 2006129

Structure parameters

• Chemical name: Tricyclohexyltin N,N-diethyldithiocarbamoylacetate
• Formula: C25 H45 N O2 S2 Sn
• Calculated formula: C25 H45 N O2 S2 Sn
• SMILES: [Sn](OC(=O)CSC(=S)N(CC)CC)(C1CCCCC1)(C1CCCCC1)C1CCCCC1
• Title of publication: Tricyclohexyl[(<i>N</i>,<i>N</i>-diethylthiocarbamoylthio)acetato-<i>O</i>]tin(IV)
• Authors of publication: Ng, Seik Weng; Kumar Das, V. G.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 5
• Pages of publication: 548 - 549
• a: 9.3375 ± 0.0008 Å
• b: 10.0667 ± 0.0009 Å
• c: 17.456 ± 0.002 Å
• α: 79.866 ± 0.009°
• β: 81.874 ± 0.009°
• γ: 62.776 ± 0.007°
• Cell volume: 1432.8 ± 0.3 ų
• Cell temperature: 300 K
• Ambient diffraction temperature: 300 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0444
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for all reflections: 0.1115
• Weighted residual factors for significantly intense reflections: 0.1058
• Goodness-of-fit parameter for all reflections: 1.166
• Goodness-of-fit parameter for significantly intense reflections: 1.182
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No