The title organoselenium compound, C(19)H(13)ClO(3)Se {systematic name: 2-[(4-chloro-phen-yl)selan-yl]-2H,3H,4H,5H,6H-naphtho-[1,2-b]pyran-5,6-dione}, has the substituted 2-pyranyl ring in a half-chair conformation with the methyl-ene-C atom bound to the methine-C atom being the flap atom. The dihedral angle between the two aromatic regions of the mol-ecule is 9.96â (9)° and indicates a step-like conformation. An intra-molecular Seâ¯O inter-action of 2.8122â (13)â à is noted. In the crystal, Ï-Ï contacts between naphthyl rings [inter-centroid distance = 3.7213â (12)â à ] and between naphthyl and chloro-benzene rings [inter-centroid distance = 3.7715â (13)â à ], along with C-Clâ¯Ï(chloro-benzene) contacts, lead to supra-molecular layers parallel to the ab plane, which are connected into a three-dimensional architecture via methyl-ene-C-Hâ¯O(carbon-yl) inter-actions. The contributions of these and other weak contacts to the Hirshfeld surface is described.
2-[(4-Chloro-phen-yl)selan-yl]-3,4-di-hydro-2H-benzo[h]chromene-5,6-dione: crystal structure and Hirshfeld analysis.
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作者:Zukerman-Schpector Julio, Prado Karinne E, Name Luccas L, Cella Rodrigo, Jotani Mukesh M, Tiekink Edward R T
| 期刊: | Acta Crystallographica Section E: Crystallographic Communications | 影响因子: | 0.500 |
| 时间: | 2017 | 起止号: | 2017 May 31; 73(Pt 6):918-924 |
| doi: | 10.1107/S2056989017007605 | ||
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