Information card for entry 2231894

Structure parameters

• Chemical name: Bis{2-[(<i>E</i>)-(5-<i>tert</i>-butyl-2-hydroxyphenyl)diazenyl]benzoato}\ dimethyltin(IV)
• Formula: C36 H40 N4 O6 Sn
• Calculated formula: C36 H40 N4 O6 Sn
• SMILES: C(=O)(c1c(cccc1)/N=N/c1c(O)ccc(c1)C(C)(C)C)O[Sn]1(OC(=[O]1)c1c(/N=N/c2c(O)ccc(c2)C(C)(C)C)cccc1)(C)C
• Title of publication: Bis{2-[(<i>E</i>)-(5-<i>tert</i>-butyl-2-hydroxyphenyl)diazenyl]benzoato}dimethyltin(IV)
• Authors of publication: Basu Baul, Tushar S.; Paul, Anup; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 10
• Pages of publication: m1383 - m1384
• a: 9.6298 ± 0.0001 Å
• b: 31.8788 ± 0.0004 Å
• c: 11.0963 ± 0.0001 Å
• α: 90°
• β: 93.502 ± 0.001°
• γ: 90°
• Cell volume: 3400.05 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.05
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.065
• Weighted residual factors for all reflections included in the refinement: 0.071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes