Information card for entry 7111084

Structure parameters

• Formula: C18 H24 Cl2 Co N2 O2 S2
• Calculated formula: C16 H16 Cl2 Co0.5 N O2 S2
• Title of publication: Design, synthesis and structural investigation of a 1-D directional coordination network based on the self-assembly of an unsymmetrical mono-tridentate ligand and cobalt cation
• Authors of publication: Jouaiti, Abdelaziz; Hosseini, Mir Wais; De Cian, André
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 19
• Pages of publication: 1863
• a: 13.3874 ± 0.0004 Å
• b: 13.9184 ± 0.0007 Å
• c: 12.095 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2253.68 ± 0.19 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 7
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.057
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for all reflections: 0.125
• Weighted residual factors for all reflections included in the refinement: 0.075
• Goodness-of-fit parameter for all reflections: 2.209
• Goodness-of-fit parameter for all reflections included in the refinement: 1.376
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No