Information card for entry 8107659

Structure parameters

• Formula: C7 H6 Cu I N O6
• Calculated formula: C7 H6 Cu I N O6
• Title of publication: The crystal structure of catena-poly[aqua-(4-iodopyridine-2,6-dicarboxylato-κ 3 N,O,O ′)-copper(II)] monohydrate, C7H6NO6ICu
• Authors of publication: Kong, Yang; Lu, ChenFei; Wang, Chang-Zhao; Tian, Bin; Dang, YiXuan; Han, ZiHao
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2023
• Journal volume: 238
• Journal issue: 6
• Pages of publication: 1057 - 1059
• a: 9.7229 ± 0.0004 Å
• b: 5.1728 ± 0.0002 Å
• c: 20.8336 ± 0.0008 Å
• α: 90°
• β: 97.636 ± 0.004°
• γ: 90°
• Cell volume: 1038.53 ± 0.07 ų
• Cell temperature: 292.7 ± 0.3 K
• Ambient diffraction temperature: 292.7 ± 0.3 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: 0.0319
• Residual factor for significantly intense reflections: 0.0287
• Weighted residual factors for significantly intense reflections: 0.067
• Weighted residual factors for all reflections included in the refinement: 0.0687
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No