6533b7d9fe1ef96bd126d3f1
RESEARCH PRODUCT
Crystal structure and Hirshfeld surface analysis of dimethyl (1R*, 3aS*, 3a(1)R*, 6aS*, 9R*, 9aS*)-3a(1),5,6,9a-tetrahydro-1H,4H,9H-1,3a:6a,9-diepoxyphenalene-2,3-dicarboxylate
Kseniia A. AlekseevaPavel V. RaspertovSevim Türktekin ÇElikesirMehmet AkkurtFlavien A. A. TozeElena A. Sorokinasubject
crystal structureCrystallographyC—H...O hydrogen bondsQD901-999fused hexacyclic systemHirshfeld surface analysisdiepoxyphenalenedescription
The title diepoxyphenalene derivative, C17H18O6, 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 center dot center dot center dot O hydrogen bonds link the molecules to form inversion dimers, enclosing two R-2(2)(6) ring motifs, that stack along the a-axis direction and are arranged in layers parallel to the bc plane.
| year | journal | country | edition | language |
|---|---|---|---|---|
| 2019-04-01 |