Information card for entry 4308372

Structure parameters

• Formula: C36 H70 Cl4 N9 P3 Sb2
• Calculated formula: C36 H70 Cl4 N9 P3 Sb2
• SMILES: N(P1(=[N]2[Sb](Cl)(N([P@]2(=N[P@]2(=[N]1[Sb](N2C1CCCCC1)(Cl)Cl)NC1CCCCC1)NC1CCCCC1)C1CCCCC1)Cl)NC1CCCCC1)C1CCCCC1.N(P1(=[N]2[Sb](Cl)(N([P@@]2(=N[P@@]2(=[N]1[Sb](N2C1CCCCC1)(Cl)Cl)NC1CCCCC1)NC1CCCCC1)C1CCCCC1)Cl)NC1CCCCC1)C1CCCCC1
• Title of publication: A Spirocyclic System Comprising Both Phosphazane and Phosphazene Rings
• Authors of publication: Richards, Philip I.; Steiner, Alexander
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Journal issue: 2
• Pages of publication: 275 - 281
• a: 20.723 ± 0.003 Å
• b: 12.771 ± 0.002 Å
• c: 19.949 ± 0.003 Å
• α: 90°
• β: 114.263 ± 0.003°
• γ: 90°
• Cell volume: 4813.2 ± 1.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0859
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1198
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No