Events The 1st International Electronic Conference on Crystals

Event submissions

Published

10.3390/IECC_2018-05256

This submission belongs to the session D. Interactions in Crystal Structures and Crystal Engineering of the event The 1st International Electronic Conference on Crystals

Published date

21 May, 2018

Citation

Vyacheslav S. Grinev, Elena I. Linkova, Elizaveta A. Krivoshchekova, Alevtina Yu. Yegorova, Crystal structure and structural features of 8a-phenylhexahydropyrrolo[1,2-a]pyrimidin-6(2H)-one, in Proceedings of The 1st International Electronic Conference on Crystals, 21 May–31 May 2018, MDPI: Basel, Switzerland, doi: 10.3390/IECC_2018-05256

Facebook

Twitter

Crystal structure and structural features of 8a-phenylhexahydropyrrolo[1,2-a]pyrimidin-6(2H)-one

Elena I. Linkova ¹

Vyacheslav S. Grinev ^1,2

Elizaveta A. Krivoshchekova ¹

Alevtina Yu. Yegorova ¹

1. Institute of Chemistry, Chernyshevsky Saratov State University

2. Institute of Biochemistry and Physiology of Plants and Microorganisms RAS

Abstract

The construction of heterocyclic systems including pyrrolone (lactam) and fused imida-/oxa-/thiazolidine fragments is quite relevant due to the broad spectrum of biological activity exhibited by these molecules. In this work, crystal structure and the structural features of 8a-phenylhexahydropyrrolo[1,2-a]pyrimidine-6(2H)-one, C13H16N2O, are reported. Titled compound crystallizes with Z = 4 in the space group P21/n with cell volume of 1109.6(4) Å3 [a = 6.0910(13) Å, b = 17.016(4) Å, c = 10.707(2) Å, β = 90.581(5)°]. Molecules in the solid state are weakly linked by the intermolecular hydrogen bonds C=O···H–N into the chains.

Keywords

Crystal structure

8a-phenylhexahydropyrrolo[1,2-a]pyrimidine-6(2H)-one

intermolecular hydrogen bonds

Manuscript

sciforum-018538-original.pdf

π-π Stacking interactions of 3a-Aryl-2,3,3a,4-tetrahydro-1H-benzo[d]pyrrolo[1,2-a]imidazol-1-ones, X-Ray and DFT Study

Nanomaterials in liquid crystals as ion-generating and ion-capturing objects