Information card for entry 8106072

Structure parameters

• Formula: C27 H20 F N3 S2 Sn
• Calculated formula: C27 H20 F N3 S2 Sn
• SMILES: [Sn]1([n]2nc(/N=C/c3ccc(F)cc3)sc2S1)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Crystal structure of 1-(4-fluorophenyl)-N-(5-((triphenylstannyl)thio)thiophen-2-yl)methanimine, C27H20FN3S2Sn
• Authors of publication: Meng, Fankun; Jia, Junying; Liu, Hongsheng
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 233
• Journal issue: 1
• Pages of publication: 129 - 130
• a: 15.631 ± 0.004 Å
• b: 9.865 ± 0.003 Å
• c: 17.256 ± 0.003 Å
• α: 90°
• β: 108.335 ± 0.0011°
• γ: 90°
• Cell volume: 2525.8 ± 1.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.0764
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for significantly intense reflections: 0.0763
• Weighted residual factors for all reflections included in the refinement: 0.0917
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No