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Information card for entry 2237083
Preview
Coordinates | 2237083.cif |
---|---|
Structure factors | 2237083.hkl |
Original IUCr paper | HTML |
Chemical name | [μ-1,2,3,4-Tetrakis(pyridin-4-yl)butane- κ^2^<i>N</i>^1^:<i>N</i>^4^]bis[trimethyl(thiocyanato-κ<i>N</i>)tin(IV)] |
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Formula | C32 H40 N6 S2 Sn2 |
Calculated formula | C32 H40 N6 S2 Sn2 |
SMILES | C[Sn](C)(C)(N=C=S)[n]1ccc(cc1)C[C@H]([C@H](Cc1cc[n](cc1)[Sn](C)(C)(C)N=C=S)c1ccncc1)c1ccncc1 |
Title of publication | [μ-1,2,3,4-Tetrakis(pyridin-4-yl)butane-κ^2^<i>N</i>^1^:<i>N</i>^4^]bis[trimethyl(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 | 2012 |
Journal volume | 68 |
Journal issue | 12 |
Pages of publication | m1550 |
a | 9.2959 ± 0.0008 Å |
b | 9.721 ± 0.0007 Å |
c | 10.2448 ± 0.0009 Å |
α | 90.388 ± 0.007° |
β | 94.381 ± 0.007° |
γ | 103.646 ± 0.007° |
Cell volume | 896.72 ± 0.13 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 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 | 0.0383 |
Residual factor for significantly intense reflections | 0.031 |
Weighted residual factors for significantly intense reflections | 0.0701 |
Weighted residual factors for all reflections included in the refinement | 0.0764 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
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/2237083.html
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Users of the data should acknowledge the original authors of the
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