Information card for entry 1512991

Structure parameters

• Formula: C20 H22 Cl4 N2 O3 Zn
• Calculated formula: C20 H22 Cl4 N2 O3 Zn
• Title of publication: Exploring supramolecular interactions between inorganic tetrachlorometallate and organic pyridinium dication: Synthesis, characterization and structural investigations
• Authors of publication: Kamal Kumar Bisht; Amal Cherian Kathalikkattil; Suresh Eringathodi
• Journal of publication: Journal of Molecular Structure
• Year of publication: 2012
• Journal volume: 1013
• Journal issue: 0
• Pages of publication: 102 - 110
• a: 8.1684 ± 0.0011 Å
• b: 8.6173 ± 0.0012 Å
• c: 17.17 ± 0.002 Å
• α: 97.796 ± 0.002°
• β: 93.831 ± 0.002°
• γ: 102.295 ± 0.002°
• Cell volume: 1164.2 ± 0.3 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0844
• Residual factor for significantly intense reflections: 0.0723
• Weighted residual factors for significantly intense reflections: 0.2034
• Weighted residual factors for all reflections included in the refinement: 0.2146
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No