Information card for entry 2007427

Structure parameters

• Common name: Doxylamine tetrachlorocobaltate(II)
• Formula: C17 H24 Cl4 Co N2 O
• Calculated formula: C17 H24 Cl4 Co N2 O
• SMILES: [Co](Cl)(Cl)([Cl-])[Cl-].O(C(c1[nH+]cccc1)(c1ccccc1)C)CC[NH+](C)C
• Title of publication: Doxylaminium Tetrachlorozincate(II) and Doxylaminium Tetrachlorocobaltate(II)
• Authors of publication: Parvez, Masood; Sabir, Aaliya P.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 7
• Pages of publication: 933 - 935
• a: 9.5279 ± 0.0012 Å
• b: 18.229 ± 0.003 Å
• c: 12.7795 ± 0.0013 Å
• α: 90°
• β: 107.313 ± 0.009°
• γ: 90°
• Cell volume: 2119 ± 0.5 ų
• Cell temperature: 170 ± 1 K
• Ambient diffraction temperature: 170 ± 1 K
• Number of distinct elements: 6
• 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: 0.215
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for all reflections included in the refinement: 0.1673
• Goodness-of-fit parameter for all reflections included in the refinement: 0.953
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No