Information card for entry 7015512

Structure parameters

• Formula: C10 H13 Cl2 N4 S Sb
• Calculated formula: C10 H13 Cl2 N4 S Sb
• SMILES: [Sb]12(SC(=N[N]1=C(c1[n]2cccc1)C)N(C)C)(Cl)Cl
• Title of publication: Indium(III), antimony(III) and bismuth(III) dihalide complexes with tridentate, anionic thio- and selenosemicarbazonato ligands.
• Authors of publication: Molter, Anja; Mohr, Fabian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 14
• Pages of publication: 3754 - 3758
• a: 8.3795 ± 0.0012 Å
• b: 15.2295 ± 0.0017 Å
• c: 11.4394 ± 0.0018 Å
• α: 90°
• β: 95.786 ± 0.013°
• γ: 90°
• Cell volume: 1452.4 ± 0.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.2101
• Residual factor for significantly intense reflections: 0.0622
• Weighted residual factors for significantly intense reflections: 0.0687
• Weighted residual factors for all reflections included in the refinement: 0.0841
• Goodness-of-fit parameter for all reflections included in the refinement: 0.73
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No