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Information card for entry 4031821
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Coordinates | 4031821.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | 10 in manuscript |
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Formula | C41 H49 Cl7 N4 Si2 |
Calculated formula | C41 H49 Cl7 N4 Si2 |
Title of publication | Halogenated Symmetrical Tetraazapentacenes: Synthesis, Structures, and Properties. |
Authors of publication | Engelhart, Jens U.; Paulus, Fabian; Schaffroth, Manuel; Vasilenko, Vladislav; Tverskoy, Olena; Rominger, Frank; Bunz, Uwe H. F. |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2016 |
Journal volume | 81 |
Journal issue | 3 |
Pages of publication | 1198 - 1205 |
a | 8.777 ± 0.002 Å |
b | 8.817 ± 0.002 Å |
c | 29.942 ± 0.007 Å |
α | 88.066 ± 0.006° |
β | 87.812 ± 0.006° |
γ | 76.754 ± 0.006° |
Cell volume | 2253.1 ± 0.9 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1399 |
Residual factor for significantly intense reflections | 0.0805 |
Weighted residual factors for significantly intense reflections | 0.1482 |
Weighted residual factors for all reflections included in the refinement | 0.1765 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.073 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4031821.html
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