Information card for entry 2208165

Structure parameters

• Chemical name: Dichlorooctakis(di-2,4-chlorobenzyl)di-μ~2~-methanolato-di-μ~3~-oxo- tetratin(IV)
• Formula: C58 H46 Cl18 O4 Sn4
• Calculated formula: C58 H46 Cl18 O4 Sn4
• SMILES: C(c1c(cc(cc1)Cl)Cl)[Sn]1(Cc2c(Cl)cc(cc2)Cl)([O]2[Sn]([O]1C)(Cc1c(cc(cc1)Cl)Cl)(Cc1c(cc(cc1)Cl)Cl)[O]1[Sn](Cc3c(cc(cc3)Cl)Cl)(Cc3c(cc(cc3)Cl)Cl)([O](C)[Sn]21(Cc1c(cc(cc1)Cl)Cl)Cc1c(cc(cc1)Cl)Cl)Cl)Cl
• Title of publication: Dichlorooctakis(di-2,4-chlorobenzyl)di-μ~2~-methanolato-di-μ~3~-oxo-tetratin(IV)
• Authors of publication: Gang Li; Handong Yin; Daqi Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 2
• Pages of publication: m366 - m368
• a: 12.462 ± 0.003 Å
• b: 21.277 ± 0.005 Å
• c: 14.201 ± 0.003 Å
• α: 90°
• β: 113.045 ± 0.003°
• γ: 90°
• Cell volume: 3465 ± 1.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0924
• Residual factor for significantly intense reflections: 0.0451
• Weighted residual factors for significantly intense reflections: 0.0982
• Weighted residual factors for all reflections included in the refinement: 0.1286
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes