Information card for entry 4328061

Structure parameters

• Formula: C13 H28 N2 P2
• Calculated formula: C13 H28 N2 P2
• Title of publication: Formation of Phosphino-Substituted Isocyanate by Reaction of CO2 with Group 2 Complexes Based on the (Me3Si)(i-Pr2P)NH Ligand
• Authors of publication: Diane A. Dickie; Kevin B. Gislason; Richard A. Kemp
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 1162 - 1169
• a: 8.3294 ± 0.0003 Å
• b: 8.4283 ± 0.0003 Å
• c: 11.9681 ± 0.0004 Å
• α: 74.085 ± 0.002°
• β: 89.399 ± 0.002°
• γ: 89.489 ± 0.002°
• Cell volume: 807.93 ± 0.05 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0577
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.1063
• Weighted residual factors for all reflections included in the refinement: 0.1259
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No