Information card for entry 7046995

Structure parameters

• Formula: C33 H26 Cl4 O2 P2 Ru
• Calculated formula: C32 H24 Cl2 O2 P2 Ru
• Title of publication: A new diphosphine-carbonyl complex of ruthenium: an efficient precursor for C-C and C-N bond coupling catalysis.
• Authors of publication: Mukherjee, Aparajita; Hrovat, David A.; Richmond, Michael G.; Bhattacharya, Samaresh
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 30
• Pages of publication: 10264 - 10272
• a: 9.0132 ± 0.0002 Å
• b: 11.0476 ± 0.0003 Å
• c: 18.2117 ± 0.0005 Å
• α: 75.668 ± 0.001°
• β: 76.977 ± 0.001°
• γ: 68.398 ± 0.001°
• Cell volume: 1615.34 ± 0.07 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0305
• Residual factor for significantly intense reflections: 0.0252
• Weighted residual factors for significantly intense reflections: 0.0571
• Weighted residual factors for all reflections included in the refinement: 0.0593
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No