Information card for entry 1564608

Structure parameters

• Formula: C27 H22 N2 O2
• Calculated formula: C27 H22 N2 O2
• SMILES: O(c1c2c(cccc2OC)c2C(=C3c4cccnc4c4ncccc34)C(Cc2c1)C)C
• Title of publication: Coordination-directed self-assembly of molecular motors: towards a two-wheel drive nanocar.
• Authors of publication: Li, Menglian; Li, Shaorui; Zhang, Kexin; Chi, Xin; Zhou, Hang; Xu, Hai-Bing; Zhang, Yuexing; Li, Quan; Wang, Dong; Zeng, Ming-Hua
• Journal of publication: Nanoscale
• Year of publication: 2021
• Journal volume: 13
• Journal issue: 39
• Pages of publication: 16748 - 16754
• a: 10.859 ± 0.0002 Å
• b: 11.9981 ± 0.0002 Å
• c: 16.6267 ± 0.0002 Å
• α: 76.377 ± 0.001°
• β: 89.763 ± 0.001°
• γ: 76.25 ± 0.001°
• Cell volume: 2041.88 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0447
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.1164
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No