The asymmetric unit of the title compound, C(13)H(12)N(2)O(2), obtained in a search for analogs of the fungicide fludioxonil [systematic name: 4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile], contains two independent mol-ecules, A and B. The benzene and pyrrole rings are inclined to each other at 38.5 (1) and 29.3 (1)° in mol-ecules A and B, respectively. In the crystal, bifurcated N-H⋯(O,O) hydrogen bonds link A mol-ecules into chains along [001], while B mol-ecules are linked into layers parallel to the bc plane via bifurcated N-H⋯(N,N) hydrogen bonds.

Download full-text PDF

Source
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344663PMC
http://dx.doi.org/10.1107/S1600536812018302DOI Listing

Publication Analysis

Top Keywords

hydrogen bonds
8
4-23-dimeth-oxy-phen-yl-1h-pyrrole-3-carbonitrile asymmetric
4
asymmetric unit
4
unit title
4
title compound
4
compound c13h12n2o2
4
c13h12n2o2 search
4
search analogs
4
analogs fungicide
4
fungicide fludioxonil
4

Similar Publications

Want AI Summaries of new PubMed Abstracts delivered to your In-box?

Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!