Information card for entry 7058093

Structure parameters

• Formula: C52 H44 N4 O10 Zn2
• Calculated formula: C52 H44 N4 O10 Zn2
• Title of publication: Metal‒ligand ring aromaticity in a 2D coordination polymer used as a photosensitive electronic device
• Authors of publication: Ahmed, Faruk; Ghosh, Sourav Ranjan; Halder, Soumi; Guin, Surajit; Alam, Seikh Mafiz; Ray, Partha Pratim; Jana, Atish Dipankar; Mir, Mohammad Hedayetullah
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 6
• Pages of publication: 2710
• a: 13.447 ± 0.0005 Å
• b: 19.7664 ± 0.0007 Å
• c: 18.1854 ± 0.0006 Å
• α: 90°
• β: 108.902 ± 0.001°
• γ: 90°
• Cell volume: 4573 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.0708
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.165
• Weighted residual factors for all reflections included in the refinement: 0.1853
• Goodness-of-fit parameter for all reflections included in the refinement: 0.961
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No