Information card for entry 4083381

Structure parameters

• Formula: C88 H72 Br4 N8 O8 Sb4
• Calculated formula: C88 H72 Br4 N8 O8 Sb4
• SMILES: [Sb]1234(c5ccc(Br)cc5)O[Sb]567(O[Sb]8(O[Sb]9(Oc%10c(cccc%10)c%10[n]9n4cc%10)(O1)(n1[n]2c(c2ccccc2O3)cc1)c1ccc(Br)cc1)(Oc1ccccc1c1[n]8n5cc1)(n1[n]6c(cc1)c1ccccc1O7)c1ccc(Br)cc1)c1ccc(Br)cc1.c1c(cccc1)C.c1c(cccc1)C.c1(ccccc1)C.c1(ccccc1)C
• Title of publication: Isolation of Tetranuclear Organoantimony Oxo Clusters and Hexa-decanuclear Polyoxostibonates
• Authors of publication: Jami, Ananda Kumar; Prabhu, M. Santhana Raj; Baskar, Viswanathan
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 5
• Pages of publication: 1137
• a: 11.767 ± 0.0008 Å
• b: 28.3682 ± 0.0019 Å
• c: 24.5657 ± 0.0016 Å
• α: 90°
• β: 99.242 ± 0.001°
• γ: 90°
• Cell volume: 8093.8 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0295
• Residual factor for significantly intense reflections: 0.0258
• Weighted residual factors for significantly intense reflections: 0.0606
• Weighted residual factors for all reflections included in the refinement: 0.0621
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No