Information card for entry 8102238

Structure parameters

• Common name: Triethylammonium trichlorotriethylaminocobaltate(II)
• Chemical name: Triethylammonium trichlorotriethylaminocobaltate(II)
• Formula: C12 H31 Cl3 Co N2
• Calculated formula: C12 H31 Cl3 Co N2
• SMILES: [Co](Cl)(Cl)(Cl)[N](CC)(CC)CC.[NH+](CC)(CC)CC
• Title of publication: Crystal structure of triethylammonium trichlorotriethylaminecobaltate(II), [NH(C2H5)3][CoCl3{N(C2H5)3}]
• Authors of publication: Lothar Stahl; Luke Grocholl; Richard J. Staples
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2008
• Journal volume: 223
• Journal issue: 1
• Pages of publication: 75
• a: 12.694 ± 0.002 Å
• b: 11.186 ± 0.003 Å
• c: 13.178 ± 0.003 Å
• α: 90°
• β: 92.48 ± 0.01°
• γ: 90°
• Cell volume: 1869.5 ± 0.7 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0615
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1328
• Weighted residual factors for all reflections included in the refinement: 0.135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.245
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No