Information card for entry 7704742

Structure parameters

• Formula: C103 H96 Cl3 N12 O2 Pt4 S4
• Calculated formula: C103 H96 Cl3 N12 O2 Pt4 S4
• Title of publication: Novel tetranuclear Pd^II and Pt^II anticancer complexes derived from pyrene thiosemicarbazones.
• Authors of publication: Oliveira, Carolina G.; Romero-Canelón, Isolda; Coverdale, James P. C.; Maia, Pedro Ivo S.; Clarkson, Guy J.; Deflon, Victor M.; Sadler, Peter J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 28
• Pages of publication: 9595 - 9604
• a: 18.8631 ± 0.0008 Å
• b: 26.4584 ± 0.0012 Å
• c: 21.3233 ± 0.0008 Å
• α: 90°
• β: 91.045 ± 0.003°
• γ: 90°
• Cell volume: 10640.4 ± 0.8 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• 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: 0.1518
• Residual factor for significantly intense reflections: 0.0659
• Weighted residual factors for significantly intense reflections: 0.1462
• Weighted residual factors for all reflections included in the refinement: 0.1772
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No