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Information card for entry 7058179
Preview
Coordinates | 7058179.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C H N O |
---|---|
Calculated formula | C1.78947 H3.15789 N0.210526 O0.526316 |
Title of publication | Intertwined gababutin-based supramolecular double helix |
Authors of publication | Konda, Maruthi; Ghosh, Tapas; Mobin, Shaikh M.; Das, Apurba K. |
Journal of publication | New Journal of Chemistry |
Year of publication | 2019 |
Journal volume | 43 |
Journal issue | 12 |
Pages of publication | 4830 |
a | 9.4628 ± 0.0015 Å |
b | 10.1211 ± 0.0016 Å |
c | 10.7468 ± 0.0017 Å |
α | 90° |
β | 108.784 ± 0.004° |
γ | 90° |
Cell volume | 974.4 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0546 |
Residual factor for significantly intense reflections | 0.0457 |
Weighted residual factors for significantly intense reflections | 0.1287 |
Weighted residual factors for all reflections included in the refinement | 0.1377 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
224993 (current) | 2019-11-08 | cif/ Updating files of 7058178, 7058179, 7058180 Original log message: Adding full bibliography for 7058178--7058180.cif. |
7058179.cif |
213680 | 2019-02-16 | cif/ Adding structures of 7058178, 7058179, 7058180 via cif-deposit CGI script. |
7058179.cif |
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Users of the data should acknowledge the original authors of the
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