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Information card for entry 2228979
Preview
Coordinates | 2228979.cif |
---|---|
Structure factors | 2228979.hkl |
Original IUCr paper | HTML |
Chemical name | Dimethyl(4'-pyridyl-2,2':6',2''-terpyridine- κ^3^<i>N</i>^1^,<i>N</i>^1'^,<i>N</i>^1''^)bis(thiocyanato-κ<i>N</i>)tin(IV) |
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Formula | C24 H20 N6 S2 Sn |
Calculated formula | C24 H20 N6 S2 Sn |
SMILES | [Sn]12([n]3ccccc3c3[n]1c(cc(c3)c1ccncc1)c1[n]2cccc1)(N=C=S)(N=C=S)(C)C |
Title of publication | Dimethyl(4'-pyridyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>^1^,<i>N</i>^1'^,<i>N</i>^1''^)bis(thiocyanato-κ<i>N</i>)tin(IV) |
Authors of publication | Najafi, Ezzatollah; Amini, Mostafa M.; Ng, Seik Weng |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 2 |
Pages of publication | m211 |
a | 9.3269 ± 0.0003 Å |
b | 10.5017 ± 0.0003 Å |
c | 13.1503 ± 0.0004 Å |
α | 66.814 ± 0.003° |
β | 87.665 ± 0.003° |
γ | 83.552 ± 0.002° |
Cell volume | 1176.52 ± 0.07 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.0278 |
Residual factor for significantly intense reflections | 0.0238 |
Weighted residual factors for significantly intense reflections | 0.0552 |
Weighted residual factors for all reflections included in the refinement | 0.0595 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2228979.html
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Users of the data should acknowledge the original authors of the
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