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Information card for entry 8107434
Preview
Coordinates | 8107434.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | (E)-2-((Z)-2-((1S,4R)-3,3-dimethylbicyclo[2.2.1]heptan-2-ylidene)ethylidene) hydrazine-1-carbothioamide |
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Formula | C24 H38 N6 S2 |
Calculated formula | C24 H38 N6 S2 |
Title of publication | Crystal structure of (E)-2-((Z)-2-((1S,4R)-3,3-dimethylbicyclo[2.2.1] heptan-2-ylidene)ethylidene)hydrazine-1-carbothioamide, C24H38N6S2 |
Authors of publication | Chang, Jia-Yu; Ding, Qing-Ying; Xiao, Zhuan-Quan; Zhang, Ji; Chen, Shang-Xing |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2023 |
Journal volume | 238 |
Journal issue | 2 |
Pages of publication | 341 - 342 |
a | 5.9953 ± 0.0004 Å |
b | 7.6132 ± 0.0005 Å |
c | 15.3709 ± 0.001 Å |
α | 82.089 ± 0.005° |
β | 88.307 ± 0.006° |
γ | 75.992 ± 0.006° |
Cell volume | 674.23 ± 0.08 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.081 |
Residual factor for significantly intense reflections | 0.0587 |
Weighted residual factors for significantly intense reflections | 0.1392 |
Weighted residual factors for all reflections included in the refinement | 0.1516 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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