Information card for entry 7042658

Structure parameters

• Formula: C27 H39 P Si3
• Calculated formula: C27 H39 P Si3
• SMILES: P(c1c(cccc1)C[SiH](C)C)(c1c(cccc1)C[SiH](C)C)c1c(cccc1)C[SiH](C)C
• Title of publication: A family of rhodium and iridium complexes with semirigid benzylsilyl phosphines: from bidentate to tetradentate coordination modes
• Authors of publication: Corona-González, María Vicky; Zamora-Moreno, Julio; Cuevas-Chávez, Cynthia A.; Rufino-Felipe, Ernesto; Mothes-Martin, Emmanuelle; Coppel, Yannick; Muñoz-Hernández, Miguel A.; Vendier, Laure; Flores-Alamo, Marcos; Grellier, Mary; Sabo-Etienne, Sylviane; Montiel-Palma, Virginia
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 17.5658 ± 0.0011 Å
• b: 15.6412 ± 0.0008 Å
• c: 10.4063 ± 0.0005 Å
• α: 90°
• β: 94.735 ± 0.005°
• γ: 90°
• Cell volume: 2849.4 ± 0.3 ų
• Cell temperature: 99.9 ± 0.4 K
• Ambient diffraction temperature: 99.9 ± 0.4 K
• Number of distinct elements: 4
• 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: 0.1152
• Residual factor for significantly intense reflections: 0.1044
• Weighted residual factors for significantly intense reflections: 0.2609
• Weighted residual factors for all reflections included in the refinement: 0.2692
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No