Information card for entry 7239781

Structure parameters

• Formula: C19 H19 Cl5 Hg N2 O4
• Calculated formula: C19 H19 Cl5 Hg N2 O4
• Title of publication: Crystal formation of 1D coordination polymers based on chiral, achiral and racemic 1,2-cyclohexane scaffolds
• Authors of publication: Jouaiti, Abdelaziz; Grosshans, Philippe; Kyritsakas, Nathalie; Ferlay, Sylvie; Henry, Marc; Hosseini, Mir Wais
• Journal of publication: CrystEngComm
• Year of publication: 2020
• Journal volume: 22
• Journal issue: 10
• Pages of publication: 1746 - 1753
• a: 11.6797 ± 0.0013 Å
• b: 12.746 ± 0.002 Å
• c: 16.331 ± 0.002 Å
• α: 90°
• β: 100.554 ± 0.01°
• γ: 90°
• Cell volume: 2390.1 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.1137
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.0862
• Weighted residual factors for all reflections included in the refinement: 0.1085
• Goodness-of-fit parameter for all reflections included in the refinement: 0.823
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No