CRYSTAL STRUCTURE OF 5,6,812b-TETRAHYDRODIOXOLO]4,5-g]ISOINDOLO[1,2-a]ISOQUINOLIN-8-ONE (C17H13NO3)

The title compound was prepared by cyclization of 2-(3,4-methylenedioxyphenyl)ethyl-3-hydroxyisoindolin-l-one in concentrated hydrochloric acid. The compound crystallizes in the orthorhombic space group Pca2(1) (No. 29) with a = 27.034(5) Å, b = 4.5093(9) Å, c = 10.667(2)Å, V = 1300.4(4) Å³ and Z =...

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Autores principales:	GALDÁMEZ,ANTONIO, CASTRO-CASTILLO,VICENTE, CASSELS,BRUCE K
Lenguaje:	English
Publicado:	Sociedad Chilena de Química 2009
Materias:	crystal structure isoindolo[1,2-a]isoquinolin-8-one X-ray diffraction
Acceso en línea:	http://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0717-97072009000300026
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spelling	oai:scielo:S0717-970720090003000262010-03-17CRYSTAL STRUCTURE OF 5,6,812b-TETRAHYDRODIOXOLO]4,5-g]ISOINDOLO[1,2-a]ISOQUINOLIN-8-ONE (C17H13NO3)GALDÁMEZ,ANTONIOCASTRO-CASTILLO,VICENTECASSELS,BRUCE K crystal structure isoindolo[1,2-a]isoquinolin-8-one X-ray diffraction The title compound was prepared by cyclization of 2-(3,4-methylenedioxyphenyl)ethyl-3-hydroxyisoindolin-l-one in concentrated hydrochloric acid. The compound crystallizes in the orthorhombic space group Pca2(1) (No. 29) with a = 27.034(5) Å, b = 4.5093(9) Å, c = 10.667(2)Å, V = 1300.4(4) Å³ and Z = 4. The crystal consists of a single enantiomer. The molecule consists of two essentially flat moieties forming an dihedral angle of 116.3(2)°. The crystal slructure has intermolecular C-H-O interactions resulting in chains that run along the crystallographic c-axis.info:eu-repo/semantics/openAccessSociedad Chilena de QuímicaJournal of the Chilean Chemical Society v.54 n.3 20092009-01-01text/htmlhttp://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0717-97072009000300026en10.4067/S0717-97072009000300026
institution	Scielo Chile
collection	Scielo Chile
language	English
topic	crystal structure isoindolo[1,2-a]isoquinolin-8-one X-ray diffraction
spellingShingle	crystal structure isoindolo[1,2-a]isoquinolin-8-one X-ray diffraction GALDÁMEZ,ANTONIO CASTRO-CASTILLO,VICENTE CASSELS,BRUCE K CRYSTAL STRUCTURE OF 5,6,812b-TETRAHYDRODIOXOLO]4,5-g]ISOINDOLO[1,2-a]ISOQUINOLIN-8-ONE (C17H13NO3)
description	The title compound was prepared by cyclization of 2-(3,4-methylenedioxyphenyl)ethyl-3-hydroxyisoindolin-l-one in concentrated hydrochloric acid. The compound crystallizes in the orthorhombic space group Pca2(1) (No. 29) with a = 27.034(5) Å, b = 4.5093(9) Å, c = 10.667(2)Å, V = 1300.4(4) Å³ and Z = 4. The crystal consists of a single enantiomer. The molecule consists of two essentially flat moieties forming an dihedral angle of 116.3(2)°. The crystal slructure has intermolecular C-H-O interactions resulting in chains that run along the crystallographic c-axis.
author	GALDÁMEZ,ANTONIO CASTRO-CASTILLO,VICENTE CASSELS,BRUCE K
author_facet	GALDÁMEZ,ANTONIO CASTRO-CASTILLO,VICENTE CASSELS,BRUCE K
author_sort	GALDÁMEZ,ANTONIO
title	CRYSTAL STRUCTURE OF 5,6,812b-TETRAHYDRODIOXOLO]4,5-g]ISOINDOLO[1,2-a]ISOQUINOLIN-8-ONE (C17H13NO3)
title_short	CRYSTAL STRUCTURE OF 5,6,812b-TETRAHYDRODIOXOLO]4,5-g]ISOINDOLO[1,2-a]ISOQUINOLIN-8-ONE (C17H13NO3)
title_full	CRYSTAL STRUCTURE OF 5,6,812b-TETRAHYDRODIOXOLO]4,5-g]ISOINDOLO[1,2-a]ISOQUINOLIN-8-ONE (C17H13NO3)
title_fullStr	CRYSTAL STRUCTURE OF 5,6,812b-TETRAHYDRODIOXOLO]4,5-g]ISOINDOLO[1,2-a]ISOQUINOLIN-8-ONE (C17H13NO3)
title_full_unstemmed	CRYSTAL STRUCTURE OF 5,6,812b-TETRAHYDRODIOXOLO]4,5-g]ISOINDOLO[1,2-a]ISOQUINOLIN-8-ONE (C17H13NO3)
title_sort	crystal structure of 5,6,812b-tetrahydrodioxolo]4,5-g]isoindolo[1,2-a]isoquinolin-8-one (c17h13no3)
publisher	Sociedad Chilena de Química
publishDate	2009
url	http://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0717-97072009000300026
work_keys_str_mv	AT galdamezantonio crystalstructureof56812btetrahydrodioxolo45gisoindolo12aisoquinolin8onec17h13no3 AT castrocastillovicente crystalstructureof56812btetrahydrodioxolo45gisoindolo12aisoquinolin8onec17h13no3 AT casselsbrucek crystalstructureof56812btetrahydrodioxolo45gisoindolo12aisoquinolin8onec17h13no3
_version_	1718445410433892352

CRYSTAL STRUCTURE OF 5,6,812b-TETRAHYDRODIOXOLO]4,5-g]ISOINDOLO[1,2-a]ISOQUINOLIN-8-ONE (C17H13NO3)

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