Information card for entry 7241010

Structure parameters

• Formula: C37 H27 N O
• Calculated formula: C37 H27 N O
• SMILES: c1ccccc1C(=C(c1ccccc1)c1ccccc1)c1ccc(cc1)/N=C/c1c2ccccc2ccc1O
• Title of publication: Organic polymorphs based on an AEE-active tetraphenylethene salicylaldehyde Schiff-base derivative: the effect of molecular conformation on luminescence properties
• Authors of publication: Liang, Chunshuang
• Journal of publication: RSC Advances
• Year of publication: 2020
• Journal volume: 10
• Journal issue: 48
• Pages of publication: 29043 - 29050
• a: 9.344 ± 0.0005 Å
• b: 12.1505 ± 0.0005 Å
• c: 12.603 ± 0.0005 Å
• α: 82.8769 ± 0.0014°
• β: 69.9436 ± 0.001°
• γ: 86.0352 ± 0.0014°
• Cell volume: 1333.18 ± 0.1 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0525
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.1167
• Weighted residual factors for all reflections included in the refinement: 0.1241
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No