Information card for entry 7006437

Structure parameters

• Chemical name: Dichloro(bis(2-diphenylphosphinoxynaphthalen-1-yl) methane)nickel(II) dichloromethane solvate
• Formula: C46 H36 Cl4 Ni O2 P2
• Calculated formula: C46 H36 Cl4 Ni O2 P2
• Title of publication: Bis(2-diphenylphosphinoxynaphthalen-1-yl)methane: transition metal chemistry, Suzuki cross-coupling reactions and homogeneous hydrogenation of olefins.
• Authors of publication: Punji, Benudhar; Mague, Joel T.; Balakrishna, Maravanji S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 10
• Pages of publication: 1322 - 1330
• a: 15.008 ± 0.001 Å
• b: 10.9488 ± 0.0009 Å
• c: 26.287 ± 0.002 Å
• α: 90°
• β: 105.429 ± 0.001°
• γ: 90°
• Cell volume: 4163.8 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0549
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.1005
• Weighted residual factors for all reflections included in the refinement: 0.1061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No