Purandara, H. ; Foro, S. ; Thimme Gowda, B. (2018)
Crystal structure and Hirshfeld surface analysis of (E)-4-chloro-N-{2-[2-(4-nitrobenzylidene)hydrazin-1-yl]-2-oxoethyl}benzenesulfonamideN,N-dimethylformamide monosolvate.
In: Acta Crystallographica Section E Crystallographic Communications, 74 (3)
doi: 10.1107/S205698901800292X
Artikel, Bibliographie
Kurzbeschreibung (Abstract)
The asymmetric unit of the title compound, C15H13ClN4O5S-C3H7NO, contains one molecule each of the Schiff base and the solvent dimethylformamide. The hydrazone group adopts an E configuration about the C=N bond. The dihedral angle between the two aromatic rings is 86.58 (2). In the crystal, pairs of N H center dot center dot center dot O hydrogen bonds between centrosymmetrically related molecules generates rings with an R(2)2(10) graph -set motif. The dimers are further linked via N-H center dot center dot center dot O and C-H center dot center dot center dot O hydrogen bonds, leading to the formation of R411) ring motifs. C-H center dot center dot center dot pi interactions are also observed. The intermolecular interactions in the crystal structure were quantified and analysed using Hirshfeld surface analysis, which indicates that the most significant contacts in packing are O center dot center dot center dot H/H center dot center dot center dot O (31.3%), followed by H center dot center dot center dot H (25.4%) and C center dot center dot center dot H/H center dot center dot center dot C(13.0%).
| Typ des Eintrags: | Artikel |
|---|---|
| Erschienen: | 2018 |
| Autor(en): | Purandara, H. ; Foro, S. ; Thimme Gowda, B. |
| Art des Eintrags: | Bibliographie |
| Titel: | Crystal structure and Hirshfeld surface analysis of (E)-4-chloro-N-{2-[2-(4-nitrobenzylidene)hydrazin-1-yl]-2-oxoethyl}benzenesulfonamideN,N-dimethylformamide monosolvate |
| Sprache: | Englisch |
| Publikationsjahr: | 1 März 2018 |
| Verlag: | International Union of Crystallography |
| Titel der Zeitschrift, Zeitung oder Schriftenreihe: | Acta Crystallographica Section E Crystallographic Communications |
| Jahrgang/Volume einer Zeitschrift: | 74 |
| (Heft-)Nummer: | 3 |
| DOI: | 10.1107/S205698901800292X |
| URL / URN: | https://doi.org/10.1107/S205698901800292X |
| Kurzbeschreibung (Abstract): | The asymmetric unit of the title compound, C15H13ClN4O5S-C3H7NO, contains one molecule each of the Schiff base and the solvent dimethylformamide. The hydrazone group adopts an E configuration about the C=N bond. The dihedral angle between the two aromatic rings is 86.58 (2). In the crystal, pairs of N H center dot center dot center dot O hydrogen bonds between centrosymmetrically related molecules generates rings with an R(2)2(10) graph -set motif. The dimers are further linked via N-H center dot center dot center dot O and C-H center dot center dot center dot O hydrogen bonds, leading to the formation of R411) ring motifs. C-H center dot center dot center dot pi interactions are also observed. The intermolecular interactions in the crystal structure were quantified and analysed using Hirshfeld surface analysis, which indicates that the most significant contacts in packing are O center dot center dot center dot H/H center dot center dot center dot O (31.3%), followed by H center dot center dot center dot H (25.4%) and C center dot center dot center dot H/H center dot center dot center dot C(13.0%). |
| Zusätzliche Informationen: | HP thanks the Department of Science and Technology, Government of India, New Delhi, for a research fellowship under its INSPIRE Program. BTG thanks the University Grants Commission, Government of India, New Delhi, for a special grant under UGC-BSR one-time grant to faculty. |
| Fachbereich(e)/-gebiet(e): | 11 Fachbereich Material- und Geowissenschaften 11 Fachbereich Material- und Geowissenschaften > Materialwissenschaft 11 Fachbereich Material- und Geowissenschaften > Materialwissenschaft > Fachgebiet Strukturforschung |
| Hinterlegungsdatum: | 14 Sep 2020 07:15 |
| Letzte Änderung: | 14 Sep 2020 07:15 |
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