Information card for entry 4336294

Structure parameters

• Chemical name: 1,3-dichloro-2,4-bis(2,6-disopropylphenyl)-cyclo-1,3-diphospha-2,4-diazane
• Formula: C24 H34 Cl2 N2 P2
• Calculated formula: C24 H34 Cl2 N2 P2
• SMILES: P1(N(P(N1c1c(cccc1C(C)C)C(C)C)Cl)c1c(cccc1C(C)C)C(C)C)Cl
• Title of publication: Synthesis of 1,3-Dichloro-cyclo-1,3-diphosphadiazanes from Silylated Amino(dichloro)phosphanes
• Authors of publication: Axel Schulz; Alexander Villinger; Andrea Westenkirchner
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 11457 - 11468
• a: 9.7403 ± 0.0003 Å
• b: 17.414 ± 0.0006 Å
• c: 15.9047 ± 0.0005 Å
• α: 90°
• β: 103.603 ± 0.002°
• γ: 90°
• Cell volume: 2622.04 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0658
• Residual factor for significantly intense reflections: 0.0483
• Weighted residual factors for significantly intense reflections: 0.096
• Weighted residual factors for all reflections included in the refinement: 0.1043
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No