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Information card for entry 7224292
Preview
Coordinates | 7224292.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H22 |
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Calculated formula | C30 H22 |
SMILES | c12ccccc1cc1ccccc1c2/C=C/c1ccccc1/C=C/c1ccccc1 |
Title of publication | Effects of substitution position on crystal packing, polymorphism and crystallization-induced emission of (9-anthryl)vinylstyrylbenzene isomers |
Authors of publication | Li, Ye-Xin; Yang, Xiao-Feng; Miao, Jin-Ling; Zhang, Zhen-Wei; Sun, Guo-Xin |
Journal of publication | CrystEngComm |
Year of publication | 2016 |
Journal volume | 18 |
Journal issue | 12 |
Pages of publication | 2098 |
a | 32.3617 ± 0.0007 Å |
b | 18.5058 ± 0.0005 Å |
c | 7.04172 ± 0.00013 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4217.14 ± 0.17 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293.15 K |
Number of distinct elements | 2 |
Space group number | 56 |
Hermann-Mauguin space group symbol | P c c n |
Hall space group symbol | -P 2ab 2ac |
Residual factor for all reflections | 0.0624 |
Residual factor for significantly intense reflections | 0.0484 |
Weighted residual factors for significantly intense reflections | 0.1275 |
Weighted residual factors for all reflections included in the refinement | 0.1403 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
181604 (current) | 2016-04-05 | cif/ Updating files of 7224291, 7224292, 7224293 Original log message: Adding full bibliography for 7224291--7224293.cif. |
7224292.cif |
176710 | 2016-02-18 | cif/ Adding structures of 7224291, 7224292, 7224293 via cif-deposit CGI script. |
7224292.cif |
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Users of the data should acknowledge the original authors of the
structural data.