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Information card for entry 1508957
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Coordinates | 1508957.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C13 H14 Cl Hg N O3 |
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Calculated formula | C13 H13.5 Cl Hg N O3 |
Title of publication | Hg(II)-Mediated Intramolecular Cyclization Reaction in Aqueous Media and Its Application as Hg(II) Selective Indicator. |
Authors of publication | Atta, Ananta Kumar; Kim, Seul-Bi; Heo, Jungseok; Cho, Dong-Gyu |
Journal of publication | Organic letters |
Year of publication | 2013 |
Journal volume | 15 |
Journal issue | 5 |
Pages of publication | 1072 - 1075 |
a | 6.9888 ± 0.0001 Å |
b | 10.8795 ± 0.0002 Å |
c | 19.1331 ± 0.0004 Å |
α | 92.887 ± 0.001° |
β | 91.033 ± 0.001° |
γ | 90.132 ± 0.001° |
Cell volume | 1452.69 ± 0.05 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 | 0.0773 |
Residual factor for significantly intense reflections | 0.0453 |
Weighted residual factors for significantly intense reflections | 0.1227 |
Weighted residual factors for all reflections included in the refinement | 0.1459 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/1508957.html
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