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Information card for entry 7001687
Preview
Coordinates | 7001687.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | k2-(N,O)-L-selenomethioninato-methylmercury |
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Chemical name | k2-(N,O)-L-selenomethioninato-methylmercury |
Formula | C6 H13 Hg N O2 Se |
Calculated formula | C6 H13 Hg N O2 Se |
SMILES | [Hg]1(OC(=O)[C@@H]([NH2]1)CC[Se]C)C |
Title of publication | Synthesis, characterization and structures of methylmercury complexes with selenoamino acids |
Authors of publication | Khan, Mohammad A. K.; Asaduzzaman, Abu Md.; Schreckenbach, Georg; Wang, Feiyue |
Journal of publication | Dalton Transactions |
Year of publication | 2009 |
Journal issue | 29 |
Pages of publication | 5766 |
a | 6.8723 ± 0.0005 Å |
b | 5.8351 ± 0.0004 Å |
c | 13.3288 ± 0.001 Å |
α | 90° |
β | 90.41 ± 0.001° |
γ | 90° |
Cell volume | 534.48 ± 0.07 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0611 |
Residual factor for significantly intense reflections | 0.0531 |
Weighted residual factors for significantly intense reflections | 0.1099 |
Weighted residual factors for all reflections included in the refinement | 0.1126 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.257 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179714 (current) | 2016-03-25 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/16. |
7001687.cif |
120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7001687.cif |
35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7001687.cif |
1143 | 2010-05-03 | cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition. |
7001687.cif |
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Users of the data should acknowledge the original authors of the
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