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Information card for entry 8106445
Preview
Coordinates | 8106445.cif |
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Original paper (by DOI) | HTML |
Formula | C15 H17 Cl N4 O S |
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Calculated formula | C15 H17 Cl N4 O S |
Title of publication | Crystal structure of (E)-1-(2-(thiophen-2-ylmethylene)hydrazinyl)phthalazine hydrochloride–ethanol (1/1), C15H17ClN4OS |
Authors of publication | El-Faham, Ayman; Ghabbour, Hazem A. |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2017 |
Journal volume | 232 |
Journal issue | 1 |
Pages of publication | 95 - 97 |
a | 7.5069 ± 0.0002 Å |
b | 9.4329 ± 0.0003 Å |
c | 11.9723 ± 0.0004 Å |
α | 81.6963 ± 0.0011° |
β | 78.2307 ± 0.0009° |
γ | 86.7 ± 0.001° |
Cell volume | 820.91 ± 0.04 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0651 |
Residual factor for significantly intense reflections | 0.0621 |
Weighted residual factors for significantly intense reflections | 0.1865 |
Weighted residual factors for all reflections included in the refinement | 0.1923 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/8106445.html
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Users of the data should acknowledge the original authors of the
structural data.