Information card for entry 2007937

Structure parameters

• Common name: Tripelennamine tetrachlorocobaltate(II)
• Chemical name: N-Benzyl-N',N'-dimethyl-N-(2-pyridinio)-1,2-ethanediammonium tetrachlorocobaltate(II)
• Formula: C16 H23 Cl4 Co N3
• Calculated formula: C16 H23 Cl4 Co N3
• SMILES: [Co](Cl)(Cl)([Cl-])[Cl-].[nH+]1ccccc1N(Cc1ccccc1)CC[NH+](C)C
• Title of publication: Tripelennamine Tetrachlorocobaltate(II)
• Authors of publication: Parvez, Masood
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 12
• Pages of publication: 1748 - 1750
• a: 11.67 ± 0.003 Å
• b: 9.78 ± 0.002 Å
• c: 17.777 ± 0.005 Å
• α: 90°
• β: 90.37 ± 0.02°
• γ: 90°
• Cell volume: 2028.9 ± 0.9 ų
• Cell temperature: 170 ± 1 K
• Ambient diffraction temperature: 170 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.177
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for all reflections included in the refinement: 0.161
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No