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Information card for entry 1505931
Preview
Coordinates | 1505931.cif |
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Original paper (by DOI) | HTML |
Formula | C12 H11 Br N2 O2 |
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Calculated formula | C12 H11 Br N2 O2 |
Title of publication | Highly regioselective transformation of alkenyl bromides into alpha-bromoaziridines and alpha-bromohydrazones. |
Authors of publication | Krasnova, Larissa B.; Yudin, Andrei K. |
Journal of publication | Organic letters |
Year of publication | 2006 |
Journal volume | 8 |
Journal issue | 10 |
Pages of publication | 2011 - 2014 |
a | 7.8657 ± 0.0005 Å |
b | 9.0257 ± 0.0005 Å |
c | 9.668 ± 0.0006 Å |
α | 64.462 ± 0.004° |
β | 75.228 ± 0.003° |
γ | 74.537 ± 0.004° |
Cell volume | 589.1 ± 0.07 Å3 |
Cell temperature | 150 ± 1 K |
Ambient diffraction temperature | 150 ± 1 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0476 |
Residual factor for significantly intense reflections | 0.0362 |
Weighted residual factors for significantly intense reflections | 0.0819 |
Weighted residual factors for all reflections included in the refinement | 0.087 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176435 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
1505931.cif |
91932 | 2013-12-28 | cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 1 CIFs. |
1505931.cif |
47860 | 2012-03-26 | ../uploads/cif-deposit/cod/cif Adding structures of 1505931 via cif-deposit CGI script. |
1505931.cif |
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Users of the data should acknowledge the original authors of the
structural data.