Information card for entry 4062179

Structure parameters

• Formula: C59 H58 Cl P3 Ru
• Calculated formula: C53 H44 Cl P3 Ru
• SMILES: [Ru]12345([P](c6ccccc6)(c6ccccc6)c6ccccc6)([P](c6ccccc6)(c6ccccc6)c6c([P]1(c1ccccc1)c1ccccc1)cccc6)[cH]1[cH]2[cH]3[cH]4[cH]51.[Cl-]
• Title of publication: Effect of Chelate Ring Size on the Rate of Hydride Transfer from CpRu(P-P)H (P-P = Chelating Diphosphine) to an Iminium Cation
• Authors of publication: Guan, Hairong; Iimura, Masanori; Magee, Matthew P.; Norton, Jack R.; Janak, Kevin E.
• Journal of publication: Organometallics
• Year of publication: 2003
• Journal volume: 22
• Journal issue: 20
• Pages of publication: 4084 - 4089
• a: 9.7432 ± 0.0006 Å
• b: 23.3215 ± 0.0016 Å
• c: 20.5948 ± 0.0014 Å
• α: 90°
• β: 94.085 ± 0.001°
• γ: 90°
• Cell volume: 4667.8 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No