Information card for entry 4328057

Structure parameters

• Formula: C26 H62 N2 O2 P2 Si2 Sr
• Calculated formula: C26 H62 N2 O2 P2 Si2 Sr
• SMILES: [Sr](N(P(C(C)C)C(C)C)[Si](C)(C)C)(N(P(C(C)C)C(C)C)[Si](C)(C)C)([O]1CCCC1)[O]1CCCC1
• 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: 19.5246 ± 0.0014 Å
• b: 20.3746 ± 0.0014 Å
• c: 20.7825 ± 0.0015 Å
• α: 90°
• β: 114.544 ± 0.004°
• γ: 90°
• Cell volume: 7520.4 ± 1 ų
• Cell temperature: 228 ± 2 K
• Ambient diffraction temperature: 228 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.084
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.1025
• Weighted residual factors for all reflections included in the refinement: 0.1262
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No