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Information card for entry 2204740
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 2204740.cif |
---|---|
Structure factors | 2204740.hkl |
Original IUCr paper | HTML |
Chemical name | Bis(tetraphenylarsonium) tris(2-thioxo-1,3-dithiole-4,5-dithiolato)stannate(IV) acetone solvate |
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Formula | C60 H46 As2 O S15 Sn |
Calculated formula | C60 H46 As2 O S15 Sn |
SMILES | [Sn]123(SC4=C(S1)SC(=S)S4)(SC1=C(S2)SC(=S)S1)SC1=C(S3)SC(=S)S1.[As+](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.[As+](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.O=C(C)C |
Title of publication | Bis(tetraphenylarsonium) tris(2-thioxo-1,3-dithiole-4,5-dithiolato)stannate(IV) acetone solvate at 120K |
Authors of publication | Comerlato, Nadia M.; Ferreira, Glaucio B.; Howie, R. Alan; Wardell, James L. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2004 |
Journal volume | 60 |
Journal issue | 12 |
Pages of publication | m1781 - m1783 |
a | 11.2238 ± 0.0003 Å |
b | 14.7826 ± 0.0005 Å |
c | 19.9333 ± 0.0007 Å |
α | 99.08 ± 0.0012° |
β | 99.966 ± 0.002° |
γ | 101.187 ± 0.002° |
Cell volume | 3132.16 ± 0.18 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 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 | 0.1074 |
Residual factor for significantly intense reflections | 0.0453 |
Weighted residual factors for significantly intense reflections | 0.0668 |
Weighted residual factors for all reflections included in the refinement | 0.0793 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.927 |
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/2204740.html
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