Crystal structure of 4-bromo-5,7-dimeth-oxy-2,3-di-hydro-1 H -inden-1-one

In the title mol-ecule, C H BrO , the di-hydro-indene moiety is essentially planar but with a slight twist in the saturated portion of the five-membered ring. The meth-oxy groups lie close to the above plane. In the crystal, π-stacking inter-actions between six-membered rings form stacks of mol-ecul...

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Veröffentlicht in:Acta crystallographica. Section E, Crystallographic communications Crystallographic communications, 2024-08, Vol.80 (Pt 8), p.873
Hauptverfasser: Galla, Sri Hari, Sridhar, Jayalakshmi, Mague, Joel T, Zhang, Xiaodong, White, Kira D, Zhang, Qiang, Donahue, James P
Format: Artikel
Sprache:eng
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Zusammenfassung:In the title mol-ecule, C H BrO , the di-hydro-indene moiety is essentially planar but with a slight twist in the saturated portion of the five-membered ring. The meth-oxy groups lie close to the above plane. In the crystal, π-stacking inter-actions between six-membered rings form stacks of mol-ecules extending along the axis direction, which are linked by weak C-H⋯O and C-H⋯Br hydrogen bonds. A Hirshfeld surface analysis was performed showing H⋯H, O⋯H/H⋯O and Br⋯H/H⋯Br contacts make the largest contributions to inter-molecular inter-actions in the crystal.
ISSN:2056-9890
2056-9890