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Information card for entry 1555458
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Coordinates | 1555458.cif |
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Original paper (by DOI) | HTML |
Formula | C56 H40 F6 N6 |
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Calculated formula | C56 H40 F6 N6 |
Title of publication | Extension of Pyrrolopyrrole π-System: Approach to Constructing Hexacyclic Nitrogen-Containing Aromatic Systems. |
Authors of publication | Tasior, Mariusz; Chotkowski, Maciej; Gryko, Daniel T. |
Journal of publication | Organic letters |
Year of publication | 2015 |
Journal volume | 17 |
Journal issue | 24 |
Pages of publication | 6106 - 6109 |
a | 7.398 ± 0.002 Å |
b | 11.831 ± 0.003 Å |
c | 25.874 ± 0.007 Å |
α | 90° |
β | 94.823 ± 0.018° |
γ | 90° |
Cell volume | 2256.6 ± 1 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0862 |
Residual factor for significantly intense reflections | 0.0639 |
Weighted residual factors for significantly intense reflections | 0.1661 |
Weighted residual factors for all reflections included in the refinement | 0.184 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
238715 (current) | 2019-11-24 | cif/ Adding structures of 1555458 via cif-deposit CGI script. |
1555458.cif |
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