Information card for entry 7030321

Structure parameters

• Formula: C88 H72 Cl4 N4 O10 Sb4
• Calculated formula: C88 H72 Cl4 N4 O10 Sb4
• SMILES: c12c3cccc2ccc[n]1[Sb]12(O3)(O[Sb]34([n]5c6c(cccc6ccc5)O3)(O[Sb]3(O1)([n]1c5c(cccc5ccc1)O3)(O[Sb]1([n]3c5c(cccc5ccc3)O1)(O2)(O4)c1ccc(cc1)Cl)c1ccc(cc1)Cl)c1ccc(cc1)Cl)c1ccc(cc1)Cl.Cc1ccccc1.Cc1ccccc1.Cc1ccccc1.Cc1ccccc1
• Title of publication: Tetranuclear stiboxanes (RSb)4O6, exhibiting an adamantane-type structure.
• Authors of publication: Jami, Ananda Kumar; Baskar, Viswanathan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 40
• Pages of publication: 12524 - 12529
• a: 19.4622 ± 0.001 Å
• b: 19.4622 ± 0.001 Å
• c: 20.882 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7909.6 ± 1 ų
• Cell temperature: 373 ± 2 K
• Ambient diffraction temperature: 373 ± 2 K
• Number of distinct elements: 6
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0306
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for significantly intense reflections: 0.0749
• Weighted residual factors for all reflections included in the refinement: 0.0767
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No