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A second monoclinic polymorph of 4-(2-hydr­oxy-4-methoxy­benzyl­ideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one

The title compound, C(19)H(19)N(3)O(3), prepared by condensing 4-amino­anti­pyrine and 4-meth­oxy-2-hydroxy­benzaldehyde in methanol, is the second monoclinic polymorph of this compound which crystallizes in the space group C2/c. The structure was previously reported [Wang, Zhang, Yan, Zheng & Y...

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Autores principales: Zhu, Zhao-Fu, Shen, Xi-Hai, Tang, Xiao-Guang
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959388/
https://www.ncbi.nlm.nih.gov/pubmed/21201166
http://dx.doi.org/10.1107/S1600536808029498
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author Zhu, Zhao-Fu
Shen, Xi-Hai
Tang, Xiao-Guang
author_facet Zhu, Zhao-Fu
Shen, Xi-Hai
Tang, Xiao-Guang
author_sort Zhu, Zhao-Fu
collection PubMed
description The title compound, C(19)H(19)N(3)O(3), prepared by condensing 4-amino­anti­pyrine and 4-meth­oxy-2-hydroxy­benzaldehyde in methanol, is the second monoclinic polymorph of this compound which crystallizes in the space group C2/c. The structure was previously reported [Wang, Zhang, Yan, Zheng & Yang (2007 ▶). Acta Cryst. E63, o1245–o1246] in the space group P2(1)/c. The hydroxyl group is disordered over two positions with occupancies of 0.787 (4) and 0.213 (4). The triply substituted benzene ring and the phenyl ring form dihedral angles of 12.2 (2) and 53.7 (2)°, respectively, with the pyrazolone ring; the corresponding values in the P2(1)/c polymorph are 7.5 (2) and 42.6 (2)°. Intra­molecular O—H⋯N and C—H⋯O hydrogen bonds are observed in the major disorder component. Adjacent molecules are linked through intermolecular O—H⋯O hydrogen bonds, forming dimers.
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spelling pubmed-29593882010-12-30 A second monoclinic polymorph of 4-(2-hydr­oxy-4-methoxy­benzyl­ideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one Zhu, Zhao-Fu Shen, Xi-Hai Tang, Xiao-Guang Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(19)H(19)N(3)O(3), prepared by condensing 4-amino­anti­pyrine and 4-meth­oxy-2-hydroxy­benzaldehyde in methanol, is the second monoclinic polymorph of this compound which crystallizes in the space group C2/c. The structure was previously reported [Wang, Zhang, Yan, Zheng & Yang (2007 ▶). Acta Cryst. E63, o1245–o1246] in the space group P2(1)/c. The hydroxyl group is disordered over two positions with occupancies of 0.787 (4) and 0.213 (4). The triply substituted benzene ring and the phenyl ring form dihedral angles of 12.2 (2) and 53.7 (2)°, respectively, with the pyrazolone ring; the corresponding values in the P2(1)/c polymorph are 7.5 (2) and 42.6 (2)°. Intra­molecular O—H⋯N and C—H⋯O hydrogen bonds are observed in the major disorder component. Adjacent molecules are linked through intermolecular O—H⋯O hydrogen bonds, forming dimers. International Union of Crystallography 2008-09-20 /pmc/articles/PMC2959388/ /pubmed/21201166 http://dx.doi.org/10.1107/S1600536808029498 Text en © Zhu et al. 2008 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
Zhu, Zhao-Fu
Shen, Xi-Hai
Tang, Xiao-Guang
A second monoclinic polymorph of 4-(2-hydr­oxy-4-methoxy­benzyl­ideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
title A second monoclinic polymorph of 4-(2-hydr­oxy-4-methoxy­benzyl­ideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
title_full A second monoclinic polymorph of 4-(2-hydr­oxy-4-methoxy­benzyl­ideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
title_fullStr A second monoclinic polymorph of 4-(2-hydr­oxy-4-methoxy­benzyl­ideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
title_full_unstemmed A second monoclinic polymorph of 4-(2-hydr­oxy-4-methoxy­benzyl­ideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
title_short A second monoclinic polymorph of 4-(2-hydr­oxy-4-methoxy­benzyl­ideneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
title_sort second monoclinic polymorph of 4-(2-hydr­oxy-4-methoxy­benzyl­ideneamino)-1,5-dimethyl-2-phenyl-1h-pyrazol-3(2h)-one
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959388/
https://www.ncbi.nlm.nih.gov/pubmed/21201166
http://dx.doi.org/10.1107/S1600536808029498
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