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Information card for entry 7234506
Preview
Coordinates | 7234506.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H54 N2 O2 S2 |
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Calculated formula | C38 H54 N2 O2 S2 |
Title of publication | Enhanced electron mobility in crystalline thionated naphthalene diimides |
Authors of publication | Lisa M. Kozycz; Chang Guo; Joseph G. Manion; Andrew J. Tilley; Alan J. Lough; Yuning Li; Dwight S. Seferos |
Journal of publication | Journal of Materials Chemistry C |
Year of publication | 2015 |
Journal volume | 3 |
Pages of publication | 11505 - 11515 |
a | 4.642 ± 0.0002 Å |
b | 46.2015 ± 0.0016 Å |
c | 7.8037 ± 0.0003 Å |
α | 90° |
β | 96.678 ± 0.003° |
γ | 90° |
Cell volume | 1662.28 ± 0.11 Å3 |
Cell temperature | 147 ± 2 K |
Ambient diffraction temperature | 147 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0589 |
Residual factor for significantly intense reflections | 0.0464 |
Weighted residual factors for significantly intense reflections | 0.1113 |
Weighted residual factors for all reflections included in the refinement | 0.1188 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
219201 (current) | 2019-10-09 | cif/ Adding structures of 7234503, 7234504, 7234505, 7234506 via cif-deposit CGI script. |
7234506.cif |
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Users of the data should acknowledge the original authors of the
structural data.