Information card for entry 7251044

Structure parameters

• Chemical name: Monoclinic
• Formula: C47 H38 N2 O6 Zn
• Calculated formula: C47 H38 N2 O6 Zn
• Title of publication: Influence of cations on charge transport and Schottky properties in mesaconate-bridged isostructural 1D coordination polymers
• Authors of publication: Hossain, Ersad; Sil, Sayantan; Malik, Srikanta; Goura, Joydeb; Chatterjee, Moumita; Ray, Partha Pratim; Mir, Mohammad Hedayetullah; Mukhopadhyay, Subrata
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 46
• Pages of publication: 7531 - 7539
• a: 15.3041 ± 0.0008 Å
• b: 15.6105 ± 0.0015 Å
• c: 15.5655 ± 0.0011 Å
• α: 90°
• β: 103.72 ± 0.006°
• γ: 90°
• Cell volume: 3612.6 ± 0.5 ų
• Cell temperature: 182 ± 110 K
• Ambient diffraction temperature: 182 ± 110 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1205
• Residual factor for significantly intense reflections: 0.0869
• Weighted residual factors for significantly intense reflections: 0.2345
• Weighted residual factors for all reflections included in the refinement: 0.2628
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No