Information card for entry 2225561

Structure parameters

• Chemical name: Bis(3,5-dinitrobenzoato-κ<i>O</i>^1^)tetramethanolcobalt(II)
• Formula: C18 H22 Co N4 O16
• Calculated formula: C18 H22 Co N4 O16
• SMILES: C(=O)(c1cc(cc(c1)N(=O)=O)N(=O)=O)O[Co]([OH]C)([OH]C)(OC(=O)c1cc(cc(c1)N(=O)=O)N(=O)=O)([OH]C)[OH]C
• Title of publication: Bis(3,5-dinitrobenzoato-κ<i>O</i>^1^)tetramethanolcobalt(II)
• Authors of publication: Sarkar, Bipasa; Roy, Abhijit; Ng, Seik Weng; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 4
• Pages of publication: m365
• a: 6.4068 ± 0.0008 Å
• b: 8.766 ± 0.0011 Å
• c: 12.1603 ± 0.0016 Å
• α: 90.411 ± 0.002°
• β: 100.407 ± 0.002°
• γ: 102.214 ± 0.002°
• Cell volume: 655.78 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.06
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.1
• Weighted residual factors for all reflections included in the refinement: 0.11
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes