Information card for entry 7221542

Structure parameters

• Formula: C24 H33 Cl8 Co N3
• Calculated formula: C24 H33 Cl8 Co N3
• SMILES: [Co](Cl)(Cl)([Cl-])[Cl-].[Cl-].[NH3+][C@@H](C)c1ccc(Cl)cc1.[NH3+][C@@H](C)c1ccc(Cl)cc1.[NH3+][C@@H](C)c1ccc(Cl)cc1
• Title of publication: Racemic and Conglomerate 1-(4-Haloaryl)ethylammonium Tetrachlorocobaltate Salts: Formation of Helical Structures
• Authors of publication: Ghalsasi, Prasanna Shridhar; Mande, Hemant; Arulsamy, Navamoney
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 13.9263 ± 0.0014 Å
• b: 7.5981 ± 0.0006 Å
• c: 15.8322 ± 0.0013 Å
• α: 90°
• β: 95.173 ± 0.006°
• γ: 90°
• Cell volume: 1668.4 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0622
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0801
• Weighted residual factors for all reflections included in the refinement: 0.0894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No