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Information card for entry 7120827
Preview
Coordinates | 7120827.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C78 H55 Cd N14 O15.5 |
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Calculated formula | C78 H52 Cd N14 O15.5 |
Title of publication | Supramolecular coordination polymers using a close to ‘V-shaped’ fluorescent 4-amino-1,8-naphthalimide Tröger’s base scaffold |
Authors of publication | Gunnlaugsson, Thorfinnur; Shanmugaraju, Sankarasekaran; Hawes, Chris Samuel; Savyasachi, A. J.; Blasco, Salvador; Kitchen, Jonathan A. |
Journal of publication | Chem. Commun. |
Year of publication | 2017 |
a | 17.9643 ± 0.0008 Å |
b | 26.5902 ± 0.0013 Å |
c | 19.4124 ± 0.0008 Å |
α | 90° |
β | 115.54 ± 0.001° |
γ | 90° |
Cell volume | 8366.7 ± 0.7 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100.01 K |
Number of distinct elements | 5 |
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 | 0.1624 |
Residual factor for significantly intense reflections | 0.0698 |
Weighted residual factors for significantly intense reflections | 0.1757 |
Weighted residual factors for all reflections included in the refinement | 0.2214 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.992 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
202336 (current) | 2017-10-26 | cif/ Adding structures of 7120826, 7120827 via cif-deposit CGI script. |
7120827.cif |
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Users of the data should acknowledge the original authors of the
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