Information card for entry 8107327

Structure parameters

• Formula: C38 H38 Cl2 N2 P2 Ru
• Calculated formula: C38 H38 Cl2 N2 P2 Ru
• SMILES: C1C[NH2][Ru]([NH2]1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)(Cl)Cl
• Title of publication: The crystal structure of trans-dichlorido-(ethylenediamine-κ 2 N,N′)-bis(triphenylphosphine-κ 1 P)ruthenium(II), C38H38Cl2N2P2Ru
• Authors of publication: Ndlangamandla, Nqobile G.; Clayton, Hadley S.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2022
• Journal volume: 237
• Journal issue: 6
• Pages of publication: 1175 - 1179
• a: 10.8827 ± 0.0003 Å
• b: 30.6226 ± 0.0007 Å
• c: 20.2089 ± 0.0004 Å
• α: 90°
• β: 93.856 ± 0.001°
• γ: 90°
• Cell volume: 6719.5 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0348
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0622
• Weighted residual factors for all reflections included in the refinement: 0.0636
• Goodness-of-fit parameter for all reflections included in the refinement: 1.152
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No