Information card for entry 7234120

Structure parameters

• Formula: C68 H82 Cl2 N6 O7 Pt2
• Calculated formula: C68 H82 Cl2 N6 O7 Pt2
• Title of publication: Mechano-induced luminescent and chiroptical switching in chiral cyclometalated platinum(ii) complexes
• Authors of publication: Xiao-Peng Zhang; Jin-Feng Mei; Jian-Cheng Lai; Cheng-Hui Li; Xiao-Zeng You
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2015
• Journal volume: 3
• Pages of publication: 2350 - 2357
• a: 31.521 ± 0.003 Å
• b: 31.521 ± 0.003 Å
• c: 7.118 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 6124.8 ± 1.9 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 152
• Hermann-Mauguin space group symbol: P 31 2 1
• Hall space group symbol: P 31 2"
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.0632
• Weighted residual factors for significantly intense reflections: 0.1725
• Weighted residual factors for all reflections included in the refinement: 0.1741
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No