Information card for entry 7062058

Structure parameters

• Formula: C81 H66 Cl2 F6 Fe2 N2 O6 P4 Pt2 S2 Se2
• Calculated formula: C81 H66 Cl2 F6 Fe2 N2 O6 P4 Pt2 S2 Se2
• Title of publication: Anticancer activity of Pt-selenolate metallacycles
• Authors of publication: Pal, M. K.; Majumdar, A. G.; Vivekananda, K. V.; Wadawale, A. P.; Subramanian, M.; Bhuvanesh, N.; Dey, S.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 48
• Pages of publication: 23198 - 23212
• a: 12.8799 ± 0.0002 Å
• b: 16.5012 ± 0.0003 Å
• c: 38.1414 ± 0.0005 Å
• α: 90°
• β: 98.275 ± 0.001°
• γ: 90°
• Cell volume: 8021.9 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 11
• 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: 0.0601
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.0932
• Weighted residual factors for all reflections included in the refinement: 0.1019
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No