Information card for entry 4074954

Structure parameters

• Formula: C48 H62 B Mo N O P Rh S2
• Calculated formula: C48 H62 B Mo N O P Rh S2
• SMILES: [Rh]12345(S[Mo]6789([S]1C)(N=O)[c]1([c]6([c]9([c]8([c]71C)C)C)C)C)([P](C)(C)C)[c]1([c]3([c]4([c]5([c]21C)C)C)C)C.c1(ccccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Electrophilic O-Methylation of a Terminal Nitrosyl Ligand Attained by an Early−Late Heterobimetallic Effect
• Authors of publication: Arashiba, Kazuya; Matsukawa, Shoji; Kuwata, Shigeki; Tanabe, Yoshiaki; Iwasaki, Masakazu; Ishii, Youichi
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 3
• Pages of publication: 560
• a: 10.204 ± 0.001 Å
• b: 18.072 ± 0.003 Å
• c: 27 ± 0.005 Å
• α: 75.05 ± 0.01°
• β: 88.46 ± 0.01°
• γ: 82.92 ± 0.01°
• Cell volume: 4773.7 ± 1.3 ų
• Cell temperature: 293.1 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for all reflections included in the refinement: 0.054
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No