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Information card for entry 2003953
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Coordinates | 2003953.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | tetrabutylbis[(N,N-diethylthiocarbamylthio)acetato]distannoxane dimer |
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Formula | C60 H120 N4 O10 S8 Sn4 |
Calculated formula | C60 H120 N4 O10 S8 Sn4 |
SMILES | C(CCC)[Sn]1(CCCC)([O]=C(O[Sn]2([O]1[Sn]1(OC(=[O][Sn](CCCC)(CCCC)(OC(=O)CSC(=S)N(CC)CC)[O]21)CSC(=S)N(CC)CC)(CCCC)CCCC)(CCCC)CCCC)CSC(=S)N(CC)CC)OC(=O)CSC(=S)N(CC)CC |
Title of publication | Tetrabutylbis[(<i>N</i>,<i>N</i>-diethylthiocarbamoylthio)acetato]distannoxane Dimer |
Authors of publication | Ng, S. W.; Kumar Das, V. G. |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1995 |
Journal volume | 51 |
Journal issue | 9 |
Pages of publication | 1774 - 1776 |
a | 11.8709 ± 0.0008 Å |
b | 13.625 ± 0.002 Å |
c | 13.8088 ± 0.0014 Å |
α | 88.684 ± 0.009° |
β | 75.199 ± 0.007° |
γ | 72.618 ± 0.007° |
Cell volume | 2057.3 ± 0.4 Å3 |
Cell temperature | 298 K |
Ambient diffraction temperature | 298 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 | 0.0944 |
Residual factor for significantly intense reflections | 0.0501 |
Weighted residual factors for all reflections | 0.1133 |
Weighted residual factors for significantly intense reflections | 0.0948 |
Goodness-of-fit parameter for all reflections | 1.025 |
Goodness-of-fit parameter for significantly intense reflections | 1.077 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2003953.html
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Users of the data should acknowledge the original authors of the
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