Information card for entry 7241657

Structure parameters

• Formula: C31.72 H35.16 N2 O4 P2 S4 Zn
• Calculated formula: C31.72 H35.16 N2 O4 P2 S4 Zn
• Title of publication: Synthesis and structures of divalent Co, Ni, Zn and Cd complexes of mixed dichalcogen and dipnictogen ligands with corrosion inhibition properties: experimental and computational studies
• Authors of publication: Yusuf, Tunde L.; Quadri, Taiwo W.; Tolufashe, Gideon F.; Olasunkanmi, Lukman O.; Ebenso, Eno E.; van Zyl, Werner E.
• Journal of publication: RSC Advances
• Year of publication: 2020
• Journal volume: 10
• Journal issue: 69
• Pages of publication: 41967 - 41982
• a: 10.0298 ± 0.0001 Å
• b: 12.6887 ± 0.0002 Å
• c: 14.1918 ± 0.0002 Å
• α: 87.038 ± 0.001°
• β: 78.878 ± 0.001°
• γ: 73.535 ± 0.001°
• Cell volume: 1699.52 ± 0.04 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0307
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0764
• Weighted residual factors for all reflections included in the refinement: 0.0785
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0372
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No