Crystal structure and Hirshfeld surface analysis of dimethyl (1R,3aS,3a1 R,6aS,9R,9aS)-3a1,5,6,9a-tetra-hydro-1H,4H,9H-1,3a:6a,9-di-epoxy-phenalene-2,3-di-carboxyl-ate

The title di-epoxy-phenalene derivative, C17H18O6, comprises a fused cyclic system containing four five-membered rings (two di-hydro-furan and two tetra-hydro-furan) and one six-membered ring (cyclo-hexa-ne). The five-membered di-hydro-furan and tetra-hydro-furan rings adopt envelope conformations,...

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Veröffentlicht in:Acta crystallographica. Section E, Crystallographic communications Crystallographic communications, 2019-04, Vol.75 (Pt 4), p.460-464
Hauptverfasser: Alekseeva, Kseniia A, Raspertov, Pavel V, Çelikesir, Sevim Türktekin, Akkurt, Mehmet, Toze, Flavien A A, Sorokina, Elena A
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container_end_page 464
container_issue Pt 4
container_start_page 460
container_title Acta crystallographica. Section E, Crystallographic communications
container_volume 75
creator Alekseeva, Kseniia A
Raspertov, Pavel V
Çelikesir, Sevim Türktekin
Akkurt, Mehmet
Toze, Flavien A A
Sorokina, Elena A
description The title di-epoxy-phenalene derivative, C17H18O6, comprises a fused cyclic system containing four five-membered rings (two di-hydro-furan and two tetra-hydro-furan) and one six-membered ring (cyclo-hexa-ne). The five-membered di-hydro-furan and tetra-hydro-furan rings adopt envelope conformations, and the six-membered cyclo-hexane ring adopts a distorted chair conformation. Two methyl carboxyl-ate groups occupy adjacent positions (2- and 3-) on a tetra-hydro-furan ring. In the crystal, two pairs of C-H⋯O hydrogen bonds link the mol-ecules 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.The title di-epoxy-phenalene derivative, C17H18O6, comprises a fused cyclic system containing four five-membered rings (two di-hydro-furan and two tetra-hydro-furan) and one six-membered ring (cyclo-hexa-ne). The five-membered di-hydro-furan and tetra-hydro-furan rings adopt envelope conformations, and the six-membered cyclo-hexane ring adopts a distorted chair conformation. Two methyl carboxyl-ate groups occupy adjacent positions (2- and 3-) on a tetra-hydro-furan ring. In the crystal, two pairs of C-H⋯O hydrogen bonds link the mol-ecules 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.
doi_str_mv 10.1107/S2056989019003499
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Section E, Crystallographic communications</jtitle><date>2019-04-01</date><risdate>2019</risdate><volume>75</volume><issue>Pt 4</issue><spage>460</spage><epage>464</epage><pages>460-464</pages><issn>2056-9890</issn><eissn>2056-9890</eissn><abstract>The title di-epoxy-phenalene derivative, C17H18O6, comprises a fused cyclic system containing four five-membered rings (two di-hydro-furan and two tetra-hydro-furan) and one six-membered ring (cyclo-hexa-ne). The five-membered di-hydro-furan and tetra-hydro-furan rings adopt envelope conformations, and the six-membered cyclo-hexane ring adopts a distorted chair conformation. Two methyl carboxyl-ate groups occupy adjacent positions (2- and 3-) on a tetra-hydro-furan ring. In the crystal, two pairs of C-H⋯O hydrogen bonds link the mol-ecules 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.The title di-epoxy-phenalene derivative, C17H18O6, comprises a fused cyclic system containing four five-membered rings (two di-hydro-furan and two tetra-hydro-furan) and one six-membered ring (cyclo-hexa-ne). The five-membered di-hydro-furan and tetra-hydro-furan rings adopt envelope conformations, and the six-membered cyclo-hexane ring adopts a distorted chair conformation. Two methyl carboxyl-ate groups occupy adjacent positions (2- and 3-) on a tetra-hydro-furan ring. 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title Crystal structure and Hirshfeld surface analysis of dimethyl (1R,3aS,3a1 R,6aS,9R,9aS)-3a1,5,6,9a-tetra-hydro-1H,4H,9H-1,3a:6a,9-di-epoxy-phenalene-2,3-di-carboxyl-ate
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