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Information card for entry 7015512
Preview
Coordinates | 7015512.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C10 H13 Cl2 N4 S Sb |
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Calculated formula | C10 H13 Cl2 N4 S Sb |
SMILES | [Sb]12(SC(=N[N]1=C(c1[n]2cccc1)C)N(C)C)(Cl)Cl |
Title of publication | Indium(III), antimony(III) and bismuth(III) dihalide complexes with tridentate, anionic thio- and selenosemicarbazonato ligands. |
Authors of publication | Molter, Anja; Mohr, Fabian |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 14 |
Pages of publication | 3754 - 3758 |
a | 8.3795 ± 0.0012 Å |
b | 15.2295 ± 0.0017 Å |
c | 11.4394 ± 0.0018 Å |
α | 90° |
β | 95.786 ± 0.013° |
γ | 90° |
Cell volume | 1452.4 ± 0.4 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.2101 |
Residual factor for significantly intense reflections | 0.0622 |
Weighted residual factors for significantly intense reflections | 0.0687 |
Weighted residual factors for all reflections included in the refinement | 0.0841 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.73 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179859 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/55. |
7015512.cif |
120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7015512.cif |
35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7015512.cif |
21178 | 2011-06-21 | ../uploads/cif-deposit/cod/cif Adding structures of 7015509, 7015510, 7015511, 7015512 via cif-deposit CGI script. |
7015512.cif |
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Users of the data should acknowledge the original authors of the
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