Information card for entry 7007005

Structure parameters

• Formula: C32 H51 Cl2 N O2 P2
• Calculated formula: C32 H51 Cl2 N O2 P2
• SMILES: P(N(P(Oc1c(cc(cc1C(C)(C)C)C)C(C)(C)C)Cl)CC)(Oc1c(cc(cc1C(C)(C)C)C)C(C)(C)C)Cl
• Title of publication: Sterically encumbered acyclic diphosphazanes: synthesis, conformations and coordination behavior.
• Authors of publication: Prabusankar, Ganesan; Palanisami, Nallasamy; Murugavel, Ramaswamy; Butcher, Ray J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 17
• Pages of publication: 2140 - 2146
• a: 9.3484 ± 0.001 Å
• b: 12.216 ± 0.0009 Å
• c: 15.4244 ± 0.0011 Å
• α: 97.828 ± 0.006°
• β: 96.701 ± 0.007°
• γ: 90.327 ± 0.007°
• Cell volume: 1732.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0712
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.1207
• Weighted residual factors for all reflections included in the refinement: 0.1311
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No