Information card for entry 1554636

Structure parameters

• Formula: C42 H36 N4 O2 Pt2
• Calculated formula: C42 H36 N4 O2 Pt2
• SMILES: [Pt]12(c3c(c4[n]2cccc4)cccc3)Oc2c(C=[N]1[C@H]1[C@H]([N]3[Pt]4(Oc5c(C=3)cccc5)[n]3c(c5c4cccc5)cccc3)CCCC1)cccc2.[Pt]12(c3c(c4[n]2cccc4)cccc3)Oc2c(C=[N]1[C@@H]1[C@@H]([N]3[Pt]4(Oc5c(C=3)cccc5)[n]3c(c5c4cccc5)cccc3)CCCC1)cccc2
• Title of publication: Syntheses, crystal structures, chirality and aggregation-induced phosphorescence of stacked binuclear platinum(ii) complexes with bridging Salen ligands
• Authors of publication: Qu, Lang; Li, Chunbo; Shen, Guangyu; Gou, Fei; Song, Jintong; Wang, Man; Xu, Xuemei; Zhou, Xiangge; Xiang, Haifeng
• Journal of publication: Materials Chemistry Frontiers
• Year of publication: 2019
• Journal volume: 3
• Journal issue: 6
• Pages of publication: 1199
• a: 11.768 ± 0.0003 Å
• b: 17.4213 ± 0.0005 Å
• c: 17.5279 ± 0.0005 Å
• α: 90°
• β: 97.615 ± 0.002°
• γ: 90°
• Cell volume: 3561.77 ± 0.17 ų
• Cell temperature: 294.56 ± 0.1 K
• Ambient diffraction temperature: 294.56 ± 0.1 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: 0.053
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0851
• Weighted residual factors for all reflections included in the refinement: 0.0945
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No