Information card for entry 1518924

Structure parameters

• Formula: C18 H30 F2 O2 P2
• Calculated formula: C18 H30 F2 O2 P2
• SMILES: P(c1c(F)c(O)c(P(C(C)C)C(C)C)c(F)c1O)(C(C)C)C(C)C
• Title of publication: Bimetallic nickel complexes supported by 2,5-bis(phosphine)-1,4-hydroquinonate ligands. Structural, electrochemical and theoretical investigations
• Authors of publication: Louis R. Pignotti; Rudy L. Luck; Nihal Deligonul; John D. Protasiewicz; Kevin E. Johnson; Lillian P. Nguyen; Eugenijus Urnezius
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2015
• Journal volume: 424
• Pages of publication: 275 - 285
• a: 7.226 ± 0.001 Å
• b: 8.486 ± 0.003 Å
• c: 8.626 ± 0.002 Å
• α: 95.31 ± 0.02°
• β: 99.92 ± 0.02°
• γ: 105.63 ± 0.02°
• Cell volume: 496.4 ± 0.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.042
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.11
• Weighted residual factors for all reflections included in the refinement: 0.113
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No