Information card for entry 2238021

Structure parameters

• Chemical name: <i>trans</i>-Dichloridotetrakis[(dimethylphosphoryl)methanaminium-κ<i>O</i>]cobalt(II) bis[tetrachloridocobaltate(II)]
• Formula: C12 H44 Cl10 Co3 N4 O4 P4
• Calculated formula: C12 H44 Cl10 Co3 N4 O4 P4
• SMILES: [NH3+]CP(=[O][Co]([O]=P(C)(C)C[NH3+])([O]=P(C)(C)C[NH3+])([O]=P(C)(C)C[NH3+])(Cl)Cl)(C)C.[Co](Cl)(Cl)([Cl-])[Cl-].[Co](Cl)(Cl)([Cl-])[Cl-]
• Title of publication: <i>trans</i>-Dichloridotetrakis[(dimethylphosphoryl)methanaminium-κ<i>O</i>]cobalt(II) tetrachloridocobaltate(II)
• Authors of publication: Reiss, Guido J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 5
• Pages of publication: m248 - m249
• a: 7.7748 ± 0.0003 Å
• b: 11.1557 ± 0.0005 Å
• c: 12.1205 ± 0.0005 Å
• α: 110.738 ± 0.004°
• β: 97.688 ± 0.004°
• γ: 104.331 ± 0.005°
• Cell volume: 923.67 ± 0.08 ų
• Cell temperature: 173 ± 1 K
• Ambient diffraction temperature: 173 ± 1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0211
• Residual factor for significantly intense reflections: 0.0183
• Weighted residual factors for significantly intense reflections: 0.0405
• Weighted residual factors for all reflections included in the refinement: 0.0416
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes