Information card for entry 2204605

Structure parameters

• Chemical name: Dichlorobis(triphenylphosphine oxide-κO)nickel(II)
• Formula: C36 H30 Cl2 Ni O2 P2
• Calculated formula: C36 H30 Cl2 Ni O2 P2
• SMILES: P(c1ccccc1)(c1ccccc1)(=[O][Ni](Cl)(Cl)[O]=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: Dichlorobis(triphenylphosphine oxide-κ<i>O</i>)nickel(II)
• Authors of publication: Moreno-Fuquen, Rodolfo; Cifuentes, Olga; Valderrama Naranjo, Jaime; Serratto, Luis Manuel; Kennedy, Alan R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 12
• Pages of publication: m1861 - m1862
• a: 20.6356 ± 0.0003 Å
• b: 32.5388 ± 0.0006 Å
• c: 9.724 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6529.25 ± 0.17 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0296
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for significantly intense reflections: 0.0617
• Weighted residual factors for all reflections included in the refinement: 0.0631
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes