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Information card for entry 4132403
Preview
Coordinates | 4132403.cif |
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Original paper (by DOI) | HTML |
Formula | C84 H60 Cl4 N4 |
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Calculated formula | C84 H60 Cl4 N4 |
Title of publication | Toward Full Zigzag-Edged Nanographenes: peri-Tetracene and Its Corresponding Circumanthracene. |
Authors of publication | Ajayakumar, M. R.; Fu, Yubin; Ma, Ji; Hennersdorf, Felix; Komber, Hartmut; Weigand, Jan J.; Alfonsov, Alexey; Popov, Alexey A.; Berger, Reinhard; Liu, Junzhi; Müllen, Klaus; Feng, Xinliang |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2018 |
Journal volume | 140 |
Journal issue | 20 |
Pages of publication | 6240 - 6244 |
a | 9.2425 ± 0.0002 Å |
b | 12.1233 ± 0.0004 Å |
c | 14.1393 ± 0.0006 Å |
α | 100.537 ± 0.003° |
β | 95.652 ± 0.003° |
γ | 91.759 ± 0.002° |
Cell volume | 1548.09 ± 0.09 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 ± 0.1 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 | 0.0612 |
Residual factor for significantly intense reflections | 0.056 |
Weighted residual factors for significantly intense reflections | 0.1608 |
Weighted residual factors for all reflections included in the refinement | 0.1684 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4132403.html
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