Information card for entry 2008599

Structure parameters

• Chemical name: Dichloro[ferrocene-1,1'-diylbis(diphenylphosphine-P)]cobalt(II)
• Formula: C34 H28 Cl2 Co Fe P2
• Calculated formula: C34 H28 Cl2 Co Fe P2
• SMILES: [Co]1(Cl)(Cl)[P]([c]23[Fe]([cH]24)([cH]32)([cH]23)([cH]34)([cH]23)([cH]24)([cH]32)([cH]23)[c]34[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Dichloro[ferrocene-1,1'-diylbis(diphenylphosphine-<i>P</i>)]cobalt(II)
• Authors of publication: Park, Tae-Jin; Huh, Seong; Kim, Youngmee; Jun, Moo-Jin
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 6
• Pages of publication: 848 - 850
• a: 9.6615 ± 0.001 Å
• b: 9.7829 ± 0.001 Å
• c: 18.4857 ± 0.001 Å
• α: 101.784 ± 0.01°
• β: 96.993 ± 0.01°
• γ: 115.568 ± 0.01°
• Cell volume: 1498.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.078
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for all reflections included in the refinement: 0.095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No