| Autor: |
Kenechukwu J. Ifeanyieze, Bikimi B. Ayiya, Obinna C. Okpareke, Tatiana V. Groutso, Jonnie N. Asegbeloyin |
| Rok vydání: |
2022 |
| Předmět: |
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| Zdroj: |
Acta crystallographica. Section E, Crystallographic communications. 78(Pt 4) |
| ISSN: |
2056-9890 |
| Popis: |
The title compound, C18H14N2O3S, crystallizes in the orthorhombic crystal system and Pbca space group. The thiourea chromophore is planar to an r.m.s deviation of 0.032 Å with the thiolate sulfur atom being the most deviated. Bifurcated N—H...O intramolecular hydrogen bonds result in an S(6) supramolecular synthon. In the crystal, molecules are linked by N—H...O intermolecular hydrogen-bonding interactions and stabilized by C—H...π and π–π interactions. Hirshfeld surface analysis and fingerprint plot indicate the H...H intermolecular contacts as the highest contributor to the overall surface contacts (38%) and this is supported by the high dispersive and electrostatic interaction energies. |
| Databáze: |
OpenAIRE |
| Externí odkaz: |
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