Crystal structure and Hirshfeld surface analysis of dimethyl (1R∗,3aS∗,3a1R∗,6aS∗,9R∗,9aS∗)-3a1,5,6,9a-tetrahydro-1H,4H,9H-1,3a:6a,9-diepoxyphenalene-2,3-dicarboxylate

The title diepoxyphenalene derivative, C 17 H 18 O 6 , comprises a fused cyclic system containing four five-membered rings (two dihydrofuran and two tetrahydrofuran) and one six-membered ring (cyclohexane). The five-membered dihydrofuran and tetrahydrofuran rings adopt envelope conformations, and the six-membered cyclohexane ring adopts a distorted chair conformation. Two methyl carboxylate groups occupy adjacent positions (2- and 3-) on a tetrahydrofuran ring. In the crystal, two pairs of C-H O hydrogen bonds link the molecules to form inversion dimers, enclosing two R2 2(6) ring motifs, that stack along the α-axis direction and are arranged in layers parallel to the bc plane. © 2019 International Union of Crystallography. All rights reserved.

Authors
Alekseeva K.A. 1 , Raspertov P.V. 1 , Çelikesir S.T.2 , Akkurt M.2 , Toze F.A.A. 3 , Sorokina E.A. 1
Publisher
International Union of Crystallography
Number of issue
4
Language
English
Pages
460-464
Status
Published
Volume
75
Year
2019
Organizations
  • 1 Organic Chemistry Department, Faculty of Science, Peoples' Friendship University of Russia (RUDN University), 6 Miklukho-Maklaya St., Moscow, 117198, Russian Federation
  • 2 Department of Physics, Faculty of Sciences, Erciyes University, Kayseri, 38039, Turkey
  • 3 Department of Chemistry, Faculty of Sciences, University of Douala, PO Box 24157, Douala, Cameroon
Keywords
C-H O hydrogen bonds; crystal structure; diepoxyphenalene; fused hexacyclic system; Hirshfeld surface analysis.
Date of creation
19.07.2019
Date of change
19.07.2019
Short link
https://repository.rudn.ru/en/records/article/record/38947/
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