Information card for entry 4333411

Structure parameters

• Formula: C23 H43 B Cl F4 N2 O P2 Rh
• Calculated formula: C23 H43 B Cl F4 N2 O P2 Rh
• SMILES: [Rh]12(Cl)([P](Cc3[n]2c(C[P]1(C(C)(C)C)C(C)(C)C)ccc3)(C(C)(C)C)C(C)(C)C)N=O.[B](F)(F)(F)[F-]
• Title of publication: Mononuclear Rh(II) PNP-type complexes. Structure and reactivity.
• Authors of publication: Feller, Moran; Ben-Ari, Eyal; Gupta, Tarkeshwar; Shimon, Linda J. W.; Leitus, Gregory; Diskin-Posner, Yael; Weiner, Lev; Milstein, David
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 25
• Pages of publication: 10479 - 10490
• a: 12.526 ± 0.003 Å
• b: 7.893 ± 0.0016 Å
• c: 28.603 ± 0.006 Å
• α: 90°
• β: 93.36 ± 0.03°
• γ: 90°
• Cell volume: 2823.1 ± 1.1 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 9
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0571
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0989
• Weighted residual factors for all reflections included in the refinement: 0.1062
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No