Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2 S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2 S,S′]triphenyltin(IV)
The crystal and molecular structures of two triphenyltin dithiocarbamate compounds, viz. [Sn(C6H5)3(C8H16NS2)], (I), and [Sn(C6H5)3(C10H12NS2)], (II), are described. The dithiocarbamate ligand in each molecule coordinates in an asymmetric fashion resulting in heavily distorted tetrahedral C3S coordi...
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International Union of Crystallography
2018
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my.sunway.eprints.7972020-10-07T09:20:01Z http://eprints.sunway.edu.my/797/ Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2 S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2 S,S′]triphenyltin(IV) Rapidah Mohamad, Normah Awang, Nurul Farahana Kamaludin, Jotani, Mukesh M. Tiekink, Edward R. T. * QD Chemistry The crystal and molecular structures of two triphenyltin dithiocarbamate compounds, viz. [Sn(C6H5)3(C8H16NS2)], (I), and [Sn(C6H5)3(C10H12NS2)], (II), are described. The dithiocarbamate ligand in each molecule coordinates in an asymmetric fashion resulting in heavily distorted tetrahedral C3S coordination geometries for the Sn atoms, with the distortions traced to the close approach of the non-coordinating thione-S atom. The molecular packing in both compounds features C—H....Sn-phenyl) interactions. In (I), the donors are Sn-phenylC—H groups leading to centrosymmetric aggregates, while in (II), the donors are both Sn-phenyl-C—H and methyl-C—H groups leading to supramolecular chains propagating along the b axis. The identified aggregates assemble into their respective crystals with no directional interactions between them. An analysis of the Hirshfeld surfaces show distinctive patterns, but an overwhelming predominance (>99% in each case) of H...H, C...H/H...C and S...H/H...S contacts on the respective Hirshfeld surface. International Union of Crystallography 2018 Article PeerReviewed text en cc_by_ncuk http://eprints.sunway.edu.my/797/1/Tiekink%20E%20Crystal%20structures%20Acta%20Cryst%20E74%20630_.pdf Rapidah Mohamad, and Normah Awang, and Nurul Farahana Kamaludin, and Jotani, Mukesh M. and Tiekink, Edward R. T. * (2018) Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2 S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2 S,S′]triphenyltin(IV). Acta Crystallographica Section E Crystallographic Communications, 74 (5). pp. 630-637. ISSN 2056-9890 http://doi.org/10.1107/S2056989018005133 doi:10.1107/S2056989018005133 |
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QD Chemistry Rapidah Mohamad, Normah Awang, Nurul Farahana Kamaludin, Jotani, Mukesh M. Tiekink, Edward R. T. * Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2 S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2 S,S′]triphenyltin(IV) |
description |
The crystal and molecular structures of two triphenyltin dithiocarbamate compounds, viz. [Sn(C6H5)3(C8H16NS2)], (I), and [Sn(C6H5)3(C10H12NS2)], (II), are described. The dithiocarbamate ligand in each molecule coordinates in an asymmetric fashion resulting in heavily distorted tetrahedral C3S coordination geometries for the Sn atoms, with the distortions traced to the close approach of the non-coordinating thione-S atom. The molecular packing in both compounds features C—H....Sn-phenyl) interactions. In (I), the donors are Sn-phenylC—H groups leading to centrosymmetric aggregates, while in (II), the donors are both Sn-phenyl-C—H and methyl-C—H groups leading to supramolecular chains propagating along the b axis. The identified aggregates assemble into their respective crystals with no directional interactions between them. An analysis of the Hirshfeld surfaces show distinctive patterns, but an overwhelming predominance (>99% in each case) of H...H, C...H/H...C and S...H/H...S contacts on the respective Hirshfeld surface. |
format |
Article |
author |
Rapidah Mohamad, Normah Awang, Nurul Farahana Kamaludin, Jotani, Mukesh M. Tiekink, Edward R. T. * |
author_facet |
Rapidah Mohamad, Normah Awang, Nurul Farahana Kamaludin, Jotani, Mukesh M. Tiekink, Edward R. T. * |
author_sort |
Rapidah Mohamad, |
title |
Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2 S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2 S,S′]triphenyltin(IV) |
title_short |
Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2 S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2 S,S′]triphenyltin(IV) |
title_full |
Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2 S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2 S,S′]triphenyltin(IV) |
title_fullStr |
Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2 S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2 S,S′]triphenyltin(IV) |
title_full_unstemmed |
Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ2 S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ2 S,S′]triphenyltin(IV) |
title_sort |
crystal structures and hirshfeld surface analyses of (n-hexyl-n-methyldithiocarbamato-κ2 s,s′)triphenyltin(iv) and [n-methyl-n-(2-phenylethyl)dithiocarbamato-κ2 s,s′]triphenyltin(iv) |
publisher |
International Union of Crystallography |
publishDate |
2018 |
url |
http://eprints.sunway.edu.my/797/1/Tiekink%20E%20Crystal%20structures%20Acta%20Cryst%20E74%20630_.pdf http://eprints.sunway.edu.my/797/ http://doi.org/10.1107/S2056989018005133 |
_version_ |
1680323395792666624 |
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13.222552 |