Information card for entry 7704606

Structure parameters

• Formula: C38 H46 F2 N2 O4 Pt2
• Calculated formula: C38 H46 F2 N2 O4 Pt2
• SMILES: [Pt]12(OC(=CC(=[O]1)C(C)(C)C)C(C)(C)C)[n]1c(c3c[n]4[Pt]5(OC(=CC(=[O]5)C(C)(C)C)C(C)(C)C)c5c(c4cc23)c(F)cc(F)c5)cccc1
• Title of publication: More efficient spin-orbit coupling: adjusting the ligand field strength to the second metal ion in asymmetric binuclear platinum(ii) configurations.
• Authors of publication: Hao, Zhaoran; Zhang, Kai; Chen, Kuan; Wang, Pu; Lu, Zhiyun; Zhu, Weiguo; Liu, Yu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 25
• Pages of publication: 8722 - 8733
• a: 10.9163 ± 0.0008 Å
• b: 12.1628 ± 0.0011 Å
• c: 14.3254 ± 0.0011 Å
• α: 81.776 ± 0.003°
• β: 78.831 ± 0.002°
• γ: 89.496 ± 0.003°
• Cell volume: 1846.5 ± 0.3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.069
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.1244
• Weighted residual factors for all reflections included in the refinement: 0.1329
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No