Information card for entry 4129735

Structure parameters

• Formula: C24 H38 Ni O2 P2 Si
• Calculated formula: C24 H38 Ni O2 P2 Si
• SMILES: [Ni]12([P](Oc3c2c(ccc3)O[P]1(C(C)C)C(C)C)(C(C)C)C(C)C)[SiH2]c1ccccc1
• Title of publication: Reactions of Phenylhydrosilanes with Pincer-Nickel Complexes: Evidence for New Si-O and Si-C Bond Formation Pathways.
• Authors of publication: Hao, Jingjun; Vabre, Boris; Zargarian, Davit
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2015
• Journal volume: 137
• Journal issue: 48
• Pages of publication: 15287 - 15298
• a: 10.8153 ± 0.0002 Å
• b: 15.1273 ± 0.0003 Å
• c: 16.7307 ± 0.0003 Å
• α: 85.503 ± 0.001°
• β: 89.664 ± 0.001°
• γ: 74.894 ± 0.001°
• Cell volume: 2634.23 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0273
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0748
• Weighted residual factors for all reflections included in the refinement: 0.0754
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No