3-(4-Chlorophenyl)-3,4-dihydroquinazolin-2(1H)-one
✍ Scribed by Shi, Daqing ;Li, Zhengyi ;Shi, Chunling ;Wang, Xiangshan ;Zhang, Yong
- Publisher
- International Union of Crystallography
- Year
- 2004
- Tongue
- English
- Weight
- 294 KB
- Volume
- 60
- Category
- Article
- ISSN
- 1600-5368
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✦ Synopsis
The title compound, C 14 H 11 ClN 2 O, was synthesized by the reaction of N-(4-chlorophenyl)-2-nitrobenzylamine with triphosgene, induced by a low-valent titanium reagent (TiCl 4 /Zn). The dihydroquinazoline ring adopts a skew-boat conformation.
📜 SIMILAR VOLUMES
Single-crystal X-ray study T = 295 K Mean '(C±C) = 0.003 A Ê R factor = 0.043 wR factor = 0.119 Data-to-parameter ratio = 14.3 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
In the title compound, C 9 H 9 ClN 4 O, the dihedral angle between the substituted phenyl and triazole rings is 4.86 (5) . In the crystalline state, the molecules exist as centrosymmetrically related NÐHÁ Á ÁO hydrogen-bonded dimers.