Information card for entry 4348345

Structure parameters

• Formula: C32 H28 N2 O14 S2 Zn3
• Calculated formula: C32 H28 N2 O14 S2 Zn3
• Title of publication: Structural studies and detection of nitroaromatics by luminescent 2D coordination polymers with angular dicarboxylate ligands
• Authors of publication: Rachuri, Yadagiri; Parmar, Bhavesh; Bisht, Kamal Kumar; Suresh, Eringathodi
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2015
• Journal volume: 2
• Journal issue: 3
• Pages of publication: 228
• a: 14.0167 ± 0.0019 Å
• b: 6.0416 ± 0.0008 Å
• c: 19.452 ± 0.003 Å
• α: 90°
• β: 93.811 ± 0.002°
• γ: 90°
• Cell volume: 1643.6 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.0947
• Residual factor for significantly intense reflections: 0.0768
• Weighted residual factors for significantly intense reflections: 0.1494
• Weighted residual factors for all reflections included in the refinement: 0.1565
• Goodness-of-fit parameter for all reflections included in the refinement: 1.212
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No