Information card for entry 7029215

Structure parameters

• Formula: C62 H74 Cl10 Hg2 N4 O4
• Calculated formula: C62 H74 Cl10 Hg2 N4 O4
• Title of publication: Molecular tectonics: enantiomerically pure 1D stair-type mercury coordination networks based on rigid bismonodentate C2-chiral organic tectons.
• Authors of publication: Larpent, Patrick; Jouaiti, Abdelaziz; Kyritsakas, Nathalie; Hosseini, Mir Wais
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 1
• Pages of publication: 166 - 172
• a: 5.0861 ± 0.0002 Å
• b: 14.8867 ± 0.0008 Å
• c: 22.8798 ± 0.0011 Å
• α: 98.776 ± 0.004°
• β: 94.498 ± 0.003°
• γ: 96.439 ± 0.002°
• Cell volume: 1693.2 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0845
• Residual factor for significantly intense reflections: 0.0558
• Weighted residual factors for significantly intense reflections: 0.12
• Weighted residual factors for all reflections included in the refinement: 0.1306
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No