3-(3-Bromo­benz­yl)-1H-isochromen-1-one

In the title compound, C(16)H(11)BrO(2), the isocoumarin ring system is planar (r.m.s. deviation = 0.015 Å) and subtends a dihedral angle of 88.90 (2)° with the bromo­benzene ring. In the crystal, mol­ecules are linked, forming a three-dimensional packing pattern involving C—H⋯O inter­actions, Br⋯O...

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Autores principales: Ali, Farukh Iftakhar, Babar, Tariq Mahmood, Rama, Nasim Hasan, Jones, Peter G.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970208/
https://www.ncbi.nlm.nih.gov/pubmed/21577958
http://dx.doi.org/10.1107/S1600536809037246
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author Ali, Farukh Iftakhar
Babar, Tariq Mahmood
Rama, Nasim Hasan
Jones, Peter G.
author_facet Ali, Farukh Iftakhar
Babar, Tariq Mahmood
Rama, Nasim Hasan
Jones, Peter G.
author_sort Ali, Farukh Iftakhar
collection PubMed
description In the title compound, C(16)H(11)BrO(2), the isocoumarin ring system is planar (r.m.s. deviation = 0.015 Å) and subtends a dihedral angle of 88.90 (2)° with the bromo­benzene ring. In the crystal, mol­ecules are linked, forming a three-dimensional packing pattern involving C—H⋯O inter­actions, Br⋯O contacts [3.4734 (10) Å] and π–π stacking inter­actions with centroid–centroid distances ranging from 3.667 (2) to 3.765 (2) Å.
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spelling pubmed-29702082010-12-30 3-(3-Bromo­benz­yl)-1H-isochromen-1-one Ali, Farukh Iftakhar Babar, Tariq Mahmood Rama, Nasim Hasan Jones, Peter G. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(16)H(11)BrO(2), the isocoumarin ring system is planar (r.m.s. deviation = 0.015 Å) and subtends a dihedral angle of 88.90 (2)° with the bromo­benzene ring. In the crystal, mol­ecules are linked, forming a three-dimensional packing pattern involving C—H⋯O inter­actions, Br⋯O contacts [3.4734 (10) Å] and π–π stacking inter­actions with centroid–centroid distances ranging from 3.667 (2) to 3.765 (2) Å. International Union of Crystallography 2009-09-26 /pmc/articles/PMC2970208/ /pubmed/21577958 http://dx.doi.org/10.1107/S1600536809037246 Text en © Ali et al. 2009 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
Ali, Farukh Iftakhar
Babar, Tariq Mahmood
Rama, Nasim Hasan
Jones, Peter G.
3-(3-Bromo­benz­yl)-1H-isochromen-1-one
title 3-(3-Bromo­benz­yl)-1H-isochromen-1-one
title_full 3-(3-Bromo­benz­yl)-1H-isochromen-1-one
title_fullStr 3-(3-Bromo­benz­yl)-1H-isochromen-1-one
title_full_unstemmed 3-(3-Bromo­benz­yl)-1H-isochromen-1-one
title_short 3-(3-Bromo­benz­yl)-1H-isochromen-1-one
title_sort 3-(3-bromo­benz­yl)-1h-isochromen-1-one
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970208/
https://www.ncbi.nlm.nih.gov/pubmed/21577958
http://dx.doi.org/10.1107/S1600536809037246
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AT ramanasimhasan 33bromobenzyl1hisochromen1one
AT jonespeterg 33bromobenzyl1hisochromen1one

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