Information card for entry 4080150

Structure parameters

• Common name: (MePNPiPr)Rh(OSiPh3)
• Formula: C51 H63 N O P2 Rh Si
• Calculated formula: C51 H63 N O P2 Rh Si
• SMILES: c12c(cc(cc1)C)[P](C(C)C)(C(C)C)[Rh]1(N2c2c(cc(cc2)C)[P]1(C(C)C)C(C)C)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1.c1ccccc1C
• Title of publication: Monomeric Rhodium(II) Complexes Supported by a Diarylamido/Bis(phosphine) PNP Pincer Ligand and Their Reactivity Toward Dihydrogen
• Authors of publication: Smith, Dan A.; Herbert, David E.; Walensky, Justin R.; Ozerov, Oleg V.
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 7
• Pages of publication: 2050
• a: 12.63 ± 0.03 Å
• b: 13.75 ± 0.04 Å
• c: 15.86 ± 0.07 Å
• α: 101.55 ± 0.04°
• β: 96.3 ± 0.05°
• γ: 115.73 ± 0.03°
• Cell volume: 2370 ± 14 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1083
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1209
• Weighted residual factors for all reflections included in the refinement: 0.1461
• Goodness-of-fit parameter for all reflections included in the refinement: 0.916
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No