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Synthesis and X-ray powder diffraction data of N-benzyl-6-chloro-4-(4-methoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline

Published online by Cambridge University Press:  30 November 2012

J. A. Pinilla ,
J. A. Henao ,
M. A. Macías ,
Arnold R. Romero Bohórquez  and
Vladimir V. Kouznetsov
J. A. Pinilla
Affiliation:
Grupo de Investigación en Química Estructural (GIQUE), Escuela de Química, Facultad de Ciencias, Universidad Industrial de Santander, A.A. 678, Carrera 27, Calle 9 Ciudadela Universitaria, Bucaramanga, Colombia
J. A. Henao*
Affiliation:
Grupo de Investigación en Química Estructural (GIQUE), Escuela de Química, Facultad de Ciencias, Universidad Industrial de Santander, A.A. 678, Carrera 27, Calle 9 Ciudadela Universitaria, Bucaramanga, Colombia
M. A. Macías
Affiliation:
Grupo de Investigación en Química Estructural (GIQUE), Escuela de Química, Facultad de Ciencias, Universidad Industrial de Santander, A.A. 678, Carrera 27, Calle 9 Ciudadela Universitaria, Bucaramanga, Colombia
Arnold R. Romero Bohórquez
Affiliation:
Laboratorio de Química Orgánica y Biomolecular (LQOBio), Centro de Investigación en Biomoléculas, (CIBIMOL), Escuela de Química, Facultad de Ciencias, Universidad Industrial de Santander, A.A. 678, Carrera 27, Calle 9 Ciudadela Universitaria, Bucaramanga, Colombia
Vladimir V. Kouznetsov
Affiliation:
Laboratorio de Química Orgánica y Biomolecular (LQOBio), Centro de Investigación en Biomoléculas, (CIBIMOL), Escuela de Química, Facultad de Ciencias, Universidad Industrial de Santander, A.A. 678, Carrera 27, Calle 9 Ciudadela Universitaria, Bucaramanga, Colombia
*
a)To whom correspondence should be addressed. Electronic mail: [email protected]
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Abstract

The N-benzyl-6-chloro-4-(4-methoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline derivative (chemical formula: C24H24ClNO) was obtained from cationic imino Diels–Alder reaction catalyzed by BF3.OEt2. Molecular characterization was performed by 1H and 13C NMR, Fourier transform-infrared and gas chromatography-mass spectrometry. The X-ray powder diffraction (XRPD) pattern for the new compound was analyzed and found to be crystallized in an orthorhombic system with space group Fdd2 (No. 43) and refined unit-cell parameters a = 33.053(7) Å, b = 41.558(9) Å, c = 5.841(1) Å and V = 8023(2) Å3.

Keywords

cationic imino Diels–Alder reactionphenylpropenestetrahydroquinolineX-ray powder diffraction data
Type
New Diffraction Data
Information
Powder Diffraction , Volume 27 , Issue 4 , December 2012 , pp. 269 - 272
Copyright
Copyright © International Centre for Diffraction Data 2012

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