(4-But­oxy­phen­yl)(1H-pyrrol-2-yl)methanone

The asymmetric unit of the title compound, C(15)H(17)NO(2), contains two independent mol­ecules in which the dihedral angles between the pyrrole and benzene rings are 42.43 (9) and 45.70 (9)°. In both mol­ecules, the but­oxy chains are disordered over two sets of sites, with occupancy ratios of 0.70...

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Autores principales: Prakash, V., Kapoor, Kamini, Shet Prakash, M., Gupta, Vivek K., Kant, Rajni
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344625/
https://www.ncbi.nlm.nih.gov/pubmed/22590387
http://dx.doi.org/10.1107/S1600536812017370
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author Prakash, V.
Kapoor, Kamini
Shet Prakash, M.
Gupta, Vivek K.
Kant, Rajni
author_facet Prakash, V.
Kapoor, Kamini
Shet Prakash, M.
Gupta, Vivek K.
Kant, Rajni
author_sort Prakash, V.
collection PubMed
description The asymmetric unit of the title compound, C(15)H(17)NO(2), contains two independent mol­ecules in which the dihedral angles between the pyrrole and benzene rings are 42.43 (9) and 45.70 (9)°. In both mol­ecules, the but­oxy chains are disordered over two sets of sites, with occupancy ratios of 0.701 (7):0.299 (7) and 0.869 (4):0.131 (4). Each mol­ecule forms a dimer with an inversion-related mol­ecule, through a pair of N—H⋯O hydrogen bonds. Weak C—H⋯O inter­actions link these dimers in the crystal structure.
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spelling pubmed-33446252012-05-15 (4-But­oxy­phen­yl)(1H-pyrrol-2-yl)methanone Prakash, V. Kapoor, Kamini Shet Prakash, M. Gupta, Vivek K. Kant, Rajni Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(15)H(17)NO(2), contains two independent mol­ecules in which the dihedral angles between the pyrrole and benzene rings are 42.43 (9) and 45.70 (9)°. In both mol­ecules, the but­oxy chains are disordered over two sets of sites, with occupancy ratios of 0.701 (7):0.299 (7) and 0.869 (4):0.131 (4). Each mol­ecule forms a dimer with an inversion-related mol­ecule, through a pair of N—H⋯O hydrogen bonds. Weak C—H⋯O inter­actions link these dimers in the crystal structure. International Union of Crystallography 2012-04-25 /pmc/articles/PMC3344625/ /pubmed/22590387 http://dx.doi.org/10.1107/S1600536812017370 Text en © Prakash et al. 2012 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Prakash, V.
Kapoor, Kamini
Shet Prakash, M.
Gupta, Vivek K.
Kant, Rajni
(4-But­oxy­phen­yl)(1H-pyrrol-2-yl)methanone
title (4-But­oxy­phen­yl)(1H-pyrrol-2-yl)methanone
title_full (4-But­oxy­phen­yl)(1H-pyrrol-2-yl)methanone
title_fullStr (4-But­oxy­phen­yl)(1H-pyrrol-2-yl)methanone
title_full_unstemmed (4-But­oxy­phen­yl)(1H-pyrrol-2-yl)methanone
title_short (4-But­oxy­phen­yl)(1H-pyrrol-2-yl)methanone
title_sort (4-but­oxy­phen­yl)(1h-pyrrol-2-yl)methanone
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344625/
https://www.ncbi.nlm.nih.gov/pubmed/22590387
http://dx.doi.org/10.1107/S1600536812017370
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AT guptavivekk 4butoxyphenyl1hpyrrol2ylmethanone
AT kantrajni 4butoxyphenyl1hpyrrol2ylmethanone

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