Crystal structure of 10-[(3-oxo-3H-benzo[f]chromen-1-yl)meth­yl]-2-tri­fluoro­methyl-9a,10-di­hydro­benz[4,5]imidazo[1,2-a]pyrimidin-4(5aH)-one

In the title compound, C(25)H(14)F(3)N(3)O(3), the dihedral angle between the planes of the benz[4,5]imidazo[1,2-a]pyrimidine unit (r.m.s. deviation = 0.035 Å) and the benzochromene ring system (r.m.s. deviation = 0.106 Å) is 72.82 (5)°. In the crystal, mol­ecules are linked by C—H⋯O inter­actions,...

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Autores principales: Chandra, Kumar., Shamantha, Puttaraju, K. B., Shivashankar, K., Mahendra, M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4555409/
https://www.ncbi.nlm.nih.gov/pubmed/26396897
http://dx.doi.org/10.1107/S2056989015014425
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author Chandra,
Kumar., Shamantha
Puttaraju, K. B.
Shivashankar, K.
Mahendra, M.
author_facet Chandra,
Kumar., Shamantha
Puttaraju, K. B.
Shivashankar, K.
Mahendra, M.
author_sort Chandra,
collection PubMed
description In the title compound, C(25)H(14)F(3)N(3)O(3), the dihedral angle between the planes of the benz[4,5]imidazo[1,2-a]pyrimidine unit (r.m.s. deviation = 0.035 Å) and the benzochromene ring system (r.m.s. deviation = 0.106 Å) is 72.82 (5)°. In the crystal, mol­ecules are linked by C—H⋯O inter­actions, generating [010] C(9) chains. A weak aromatic π–π stacking inter­action [centroid–centroid separation = 3.5376 (15) Å] is also observed.
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spelling pubmed-45554092015-09-22 Crystal structure of 10-[(3-oxo-3H-benzo[f]chromen-1-yl)meth­yl]-2-tri­fluoro­methyl-9a,10-di­hydro­benz[4,5]imidazo[1,2-a]pyrimidin-4(5aH)-one Chandra, Kumar., Shamantha Puttaraju, K. B. Shivashankar, K. Mahendra, M. Acta Crystallogr E Crystallogr Commun Data Reports In the title compound, C(25)H(14)F(3)N(3)O(3), the dihedral angle between the planes of the benz[4,5]imidazo[1,2-a]pyrimidine unit (r.m.s. deviation = 0.035 Å) and the benzochromene ring system (r.m.s. deviation = 0.106 Å) is 72.82 (5)°. In the crystal, mol­ecules are linked by C—H⋯O inter­actions, generating [010] C(9) chains. A weak aromatic π–π stacking inter­action [centroid–centroid separation = 3.5376 (15) Å] is also observed. International Union of Crystallography 2015-08-22 /pmc/articles/PMC4555409/ /pubmed/26396897 http://dx.doi.org/10.1107/S2056989015014425 Text en © Chandra et al. 2015 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 Data Reports
Chandra,
Kumar., Shamantha
Puttaraju, K. B.
Shivashankar, K.
Mahendra, M.
Crystal structure of 10-[(3-oxo-3H-benzo[f]chromen-1-yl)meth­yl]-2-tri­fluoro­methyl-9a,10-di­hydro­benz[4,5]imidazo[1,2-a]pyrimidin-4(5aH)-one
title Crystal structure of 10-[(3-oxo-3H-benzo[f]chromen-1-yl)meth­yl]-2-tri­fluoro­methyl-9a,10-di­hydro­benz[4,5]imidazo[1,2-a]pyrimidin-4(5aH)-one
title_full Crystal structure of 10-[(3-oxo-3H-benzo[f]chromen-1-yl)meth­yl]-2-tri­fluoro­methyl-9a,10-di­hydro­benz[4,5]imidazo[1,2-a]pyrimidin-4(5aH)-one
title_fullStr Crystal structure of 10-[(3-oxo-3H-benzo[f]chromen-1-yl)meth­yl]-2-tri­fluoro­methyl-9a,10-di­hydro­benz[4,5]imidazo[1,2-a]pyrimidin-4(5aH)-one
title_full_unstemmed Crystal structure of 10-[(3-oxo-3H-benzo[f]chromen-1-yl)meth­yl]-2-tri­fluoro­methyl-9a,10-di­hydro­benz[4,5]imidazo[1,2-a]pyrimidin-4(5aH)-one
title_short Crystal structure of 10-[(3-oxo-3H-benzo[f]chromen-1-yl)meth­yl]-2-tri­fluoro­methyl-9a,10-di­hydro­benz[4,5]imidazo[1,2-a]pyrimidin-4(5aH)-one
title_sort crystal structure of 10-[(3-oxo-3h-benzo[f]chromen-1-yl)meth­yl]-2-tri­fluoro­methyl-9a,10-di­hydro­benz[4,5]imidazo[1,2-a]pyrimidin-4(5ah)-one
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4555409/
https://www.ncbi.nlm.nih.gov/pubmed/26396897
http://dx.doi.org/10.1107/S2056989015014425
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