5-Benzoyl-4-hydroxy-6-(4-nitrophenyl)-4-trifluoromethyl-3,4,5,6-tetrahydropyrimidin-2(1H)-one monohydrate

5-Benzoyl-4-hydroxy-6-(4-nitrophenyl)-4-trifluoromethyl-3,4,5,6-tetrahydropyrimidin-2(1H)-one monohydrate

The asymmetric unit of the title compound, C18H14F3N3O5·H2O, contains two independent formula units. The two heterocyclic molecules differ in the orientations of the benzoylphenyl group with respect to the tetrahydropyrimidine ring [C—C—C—C torsion angles of 64...

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Main Authors: Feng-Ling Yang, Jing Zhang, Chang-Sheng Yao
Format: Article
Language:English
Published: International Union of Crystallography 2009-01-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S160053680804124X
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spelling doaj-054800bc2431449c8bbf439f976e4a182020-11-25T00:52:54ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682009-01-01651o87o8810.1107/S160053680804124X5-Benzoyl-4-hydroxy-6-(4-nitrophenyl)-4-trifluoromethyl-3,4,5,6-tetrahydropyrimidin-2(1H)-one monohydrateFeng-Ling YangJing ZhangChang-Sheng YaoThe asymmetric unit of the title compound, C18H14F3N3O5·H2O, contains two independent formula units. The two heterocyclic molecules differ in the orientations of the benzoylphenyl group with respect to the tetrahydropyrimidine ring [C—C—C—C torsion angles of 64.5 (3) and 67.1 (3)°]. In both molecules the pyrimidine ring adopts a half-chair conformation. The molecules are linked into a two-dimensional network parallel to (001) by N—H...O and O—H...O hydrogen bonds.http://scripts.iucr.org/cgi-bin/paper?S160053680804124X
collection DOAJ
language English
format Article
sources DOAJ
author Feng-Ling Yang
Jing Zhang
Chang-Sheng Yao
spellingShingle Feng-Ling Yang
Jing Zhang
Chang-Sheng Yao
5-Benzoyl-4-hydroxy-6-(4-nitrophenyl)-4-trifluoromethyl-3,4,5,6-tetrahydropyrimidin-2(1H)-one monohydrate
Acta Crystallographica Section E
author_facet Feng-Ling Yang
Jing Zhang
Chang-Sheng Yao
author_sort Feng-Ling Yang
title 5-Benzoyl-4-hydroxy-6-(4-nitrophenyl)-4-trifluoromethyl-3,4,5,6-tetrahydropyrimidin-2(1H)-one monohydrate
title_short 5-Benzoyl-4-hydroxy-6-(4-nitrophenyl)-4-trifluoromethyl-3,4,5,6-tetrahydropyrimidin-2(1H)-one monohydrate
title_full 5-Benzoyl-4-hydroxy-6-(4-nitrophenyl)-4-trifluoromethyl-3,4,5,6-tetrahydropyrimidin-2(1H)-one monohydrate
title_fullStr 5-Benzoyl-4-hydroxy-6-(4-nitrophenyl)-4-trifluoromethyl-3,4,5,6-tetrahydropyrimidin-2(1H)-one monohydrate
title_full_unstemmed 5-Benzoyl-4-hydroxy-6-(4-nitrophenyl)-4-trifluoromethyl-3,4,5,6-tetrahydropyrimidin-2(1H)-one monohydrate
title_sort 5-benzoyl-4-hydroxy-6-(4-nitrophenyl)-4-trifluoromethyl-3,4,5,6-tetrahydropyrimidin-2(1h)-one monohydrate
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2009-01-01
description The asymmetric unit of the title compound, C18H14F3N3O5·H2O, contains two independent formula units. The two heterocyclic molecules differ in the orientations of the benzoylphenyl group with respect to the tetrahydropyrimidine ring [C—C—C—C torsion angles of 64.5 (3) and 67.1 (3)°]. In both molecules the pyrimidine ring adopts a half-chair conformation. The molecules are linked into a two-dimensional network parallel to (001) by N—H...O and O—H...O hydrogen bonds.
url http://scripts.iucr.org/cgi-bin/paper?S160053680804124X
work_keys_str_mv AT fenglingyang 5benzoyl4hydroxy64nitrophenyl4trifluoromethyl3456tetrahydropyrimidin21honemonohydrate
AT jingzhang 5benzoyl4hydroxy64nitrophenyl4trifluoromethyl3456tetrahydropyrimidin21honemonohydrate
AT changshengyao 5benzoyl4hydroxy64nitrophenyl4trifluoromethyl3456tetrahydropyrimidin21honemonohydrate
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