(N,N′-Diisopropyldithiocarbamato)triphenyltin(IV): crystal structure, Hirshfeld surface analysis and computational study
The crystal and molecular structures of the title triorganotin dithiocarbamate, [Sn(C6H5)3(C7H14NS2)], are described. The molecular geometry about the metal atom is highly distorted being based on a C3S tetrahedron as the dithiocarbamate ligand is asymmetrically chelating to the tin centre. The clo...
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| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
International Union of Crystallography
2019
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| Subjects: | |
| Online Access: | http://eprints.sunway.edu.my/1103/1/Tiekink%20N%20N%20Diisopropyldithiocarbamato%20Acta%20Cryst.%20%282019%29%20E75%201479.pdf http://eprints.sunway.edu.my/1103/ http://doi.org/10.1107/S2056989019012490 |
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| Institution: | Sunway University |
| Language: | English |
| Summary: | The crystal and molecular structures of the title triorganotin dithiocarbamate, [Sn(C6H5)3(C7H14NS2)], are described. The molecular geometry about the metal
atom is highly distorted being based on a C3S tetrahedron as the dithiocarbamate ligand is asymmetrically chelating to the tin centre. The close approach of the second thione-S atom [SnS = 2.9264 (4) A˚ ] is largely
responsible for the distortion. The molecular packing is almost devoid of directional interactions with only weak phenyl-C—HC(phenyl) interactions, leading to centrosymmetric dimeric aggregates, being noted. An analysis of the calculated Hirshfeld surface points to the significance of HH contacts, which contribute 66.6% of all contacts to the surface, with CH/HC [26.8%] and
SH/HH [6.6%] contacts making up the balance. |
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