Information card for entry 7707824

Structure parameters

• Formula: C11 H13 Cl N4 S Sn
• Calculated formula: C11 H13 Cl N4 S Sn
• SMILES: [Sn]12(SC(=N[N]1=Cc1[n]2cccc1)N1CCCC1)Cl
• Title of publication: Development of a multi-target anticancer Sn(ii) pyridine-2-carboxaldehyde thiosemicarbazone complex.
• Authors of publication: Wu, Junmiao; Yang, Tongfu; Wang, Xiaojun; Li, Wenjuan; Pang, Min; Sun, Hongbin; Liang, Hong; Yang, Feng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 31
• Pages of publication: 10909 - 10921
• a: 13.4062 ± 0.0003 Å
• b: 13.7584 ± 0.0005 Å
• c: 15.3342 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2828.36 ± 0.15 ų
• Cell temperature: 297.15 K
• Ambient diffraction temperature: 297.15 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0417
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for significantly intense reflections: 0.0566
• Weighted residual factors for all reflections included in the refinement: 0.0615
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No