Information card for entry 7203695

Structure parameters

• Formula: C21 H36 N3 S6 Sb
• Calculated formula: C21 H36 N3 S6 Sb
• SMILES: [Sb]1(SC(=S)N2CCCCCC2)(SC(=[S]1)N1CCCCCC1)SC(=S)N1CCCCCC1
• Title of publication: Supramolecular associations in binary antimony(iii) dithiocarbamates: influence of ligand steric bulk, influence on coordination geometry, and competition with hydrogen-bonding
• Authors of publication: Liu, Yu; Tiekink, Edward R. T.
• Journal of publication: CrystEngComm
• Year of publication: 2005
• Journal volume: 7
• Journal issue: 2
• Pages of publication: 20
• a: 10.908 ± 0.0006 Å
• b: 13.5802 ± 0.0007 Å
• c: 18.8708 ± 0.001 Å
• α: 90°
• β: 99.305 ± 0.001°
• γ: 90°
• Cell volume: 2758.6 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.135
• Residual factor for significantly intense reflections: 0.071
• Weighted residual factors for significantly intense reflections: 0.115
• Weighted residual factors for all reflections included in the refinement: 0.135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No