Vinayaka, A. C. and Manjunath, R. and Kumar, S. M. and Abdoh, M. M. and Sadashiva, M. P. and Lokanath, N. K. (2015) Synthesis, characterization, crystal structure, and hirshfeld surface analysis of (2z)-3-(methylsulfanyl)-2,3-diphenylprop 2-enenitrile. Molecular Crystals and Liquid Crystals, 609 (1). pp. 140-154. ISSN 1563-5287
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The title compound, C16H13NS (3) was synthesized and characterized by H-1 nuclear magnetic resonance (NMR), mass spectra (MS), infrared (IR), thermogravimetric analysis, differential scanning calorimeter (DSC) and finally the structure is confirmed by single crystal X-ray diffraction method. The compound 3 crystallizes in the monoclinic crystal system and space group C2/c, with crystal parameters, a = 10.99364(4) angstrom, b = 12.3517(3) angstrom, c = 20.1045(6) angstrom, beta = 103.082(3)(0), Z = 8, and V = 2647.30(14) angstrom(3). The structure of the compound reveals that the intermolecular interactions of the type C-H horizontal ellipsis pi, C- H horizontal ellipsis N, and S horizontal ellipsis S. The packing diagram of the molecules in the unit cell exhibit three-dimensional architecture. In addition inter contacts involved in intermolecular interactions are quantified using Hirshfeld surfaces analysis.
| Item Type: | Article |
|---|---|
| Subjects: | C Chemical Science > Chemistry D Physical Science > Physics |
| Divisions: | Department of > Chemistry Department of > Physics |
| Depositing User: | Users 19 not found. |
| Date Deposited: | 13 Jun 2019 05:36 |
| Last Modified: | 21 Jun 2022 09:54 |
| URI: | http://eprints.uni-mysore.ac.in/id/eprint/2766 |
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