Information card for entry 7002355

Structure parameters

• Formula: C16 H40 Cl2 N2 P2 Ru
• Calculated formula: C16 H40 Cl2 N2 P2 Ru
• SMILES: [Ru]12(Cl)(Cl)([P](CC[NH2]1)(C(C)C)C(C)C)[P](CC[NH2]2)(C(C)C)C(C)C
• Title of publication: Aminophosphine ligands R2P(CH2)nNH2 and ruthenium hydrogenation catalysts RuCl2(R2P(CH2)nNH2)2
• Authors of publication: Jia, Wenli; Chen, Xuanhua; Guo, Rongwei; Sui-Seng, Christine; Amoroso, Dino; Lough, Alan J.; Abdur-Rashid, Kamaluddin
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 39
• Pages of publication: 8301 - 8307
• a: 11.4627 ± 0.0003 Å
• b: 13.1649 ± 0.0006 Å
• c: 15.2297 ± 0.0005 Å
• α: 90°
• β: 104.992 ± 0.002°
• γ: 90°
• Cell volume: 2220.01 ± 0.14 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.0812
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.1189
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No