Information card for entry 7058320

Structure parameters

• Formula: C36 H24 N4 Pt2 S4
• Calculated formula: C36 H24 N4 Pt2 S4
• Title of publication: Half-lantern cyclometalated Pt(ii) and Pt(iii) complexes with bridging heterocyclic thiolate ligands: synthesis, structural characterization, and electrochemical and photophysical properties
• Authors of publication: Shahsavari, Hamid R.; Lalinde, Elena; Moreno, M. Teresa; Niazi, Maryam; Kazemi, Sayed Habib; Abedanzadeh, Sedigheh; Barazandeh, Mohammad; Halvagar, Mohammad Reza
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 20
• Pages of publication: 7716
• a: 12.28 ± 0.003 Å
• b: 12.69 ± 0.003 Å
• c: 21.636 ± 0.004 Å
• α: 90°
• β: 99.26 ± 0.03°
• γ: 90°
• Cell volume: 3327.7 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0673
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for significantly intense reflections: 0.044
• Weighted residual factors for all reflections included in the refinement: 0.0478
• Goodness-of-fit parameter for all reflections included in the refinement: 0.622
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No