Information card for entry 1508264

Structure parameters

• Formula: C31 H24 N2
• Calculated formula: C31 H24 N2
• SMILES: N(c1ccc(cc1)/C=C/c1cccc(c1)c1ncccc1)(c1ccccc1)c1ccccc1
• Title of publication: Photoluminescence and trans →cis photoisomerization of aminostyrene-conjugated phenylpyridine C^N ligands and their complexes with platinum(II): the styryl position and the amino substituent effects.
• Authors of publication: Lin, Che-Jen; Liu, Yi-Hung; Peng, Shie-Ming; Yang, Jye-Shane
• Journal of publication: The journal of physical chemistry. B
• Year of publication: 2012
• Journal volume: 116
• Journal issue: 28
• Pages of publication: 8222 - 8232
• a: 9.0927 ± 0.0002 Å
• b: 14.0793 ± 0.0004 Å
• c: 19.015 Å
• α: 111.408 ± 0.002°
• β: 91.151 ± 0.003°
• γ: 90.305 ± 0.002°
• Cell volume: 2265.66 ± 0.09 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1174
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.0977
• Weighted residual factors for all reflections included in the refinement: 0.1131
• Goodness-of-fit parameter for all reflections included in the refinement: 0.874
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No