Information card for entry 7251043

Structure parameters

• Chemical name: Monoclinic
• Formula: C47 H36 Cd N2 O6
• Calculated formula: C47 H36 Cd N2 O6
• 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: 15.5067 ± 0.0004 Å
• b: 16.2821 ± 0.0005 Å
• c: 15.4048 ± 0.0004 Å
• α: 90°
• β: 103.201 ± 0.003°
• γ: 90°
• Cell volume: 3786.65 ± 0.19 ų
• Cell temperature: 100 ± 0.3 K
• Ambient diffraction temperature: 100 ± 0.3 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: 0.0496
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.0959
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No