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N-(4-Methoxy­benzoyl)-N'-o-tolyl­thio­urea

✍ Scribed by Yusof, M. Sukeri M. ;Yamin, Bohari M.

Publisher
International Union of Crystallography
Year
2004
Tongue
English
Weight
235 KB
Volume
60
Category
Article
ISSN
1600-5368

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✦ Synopsis

Single-crystal X-ray study T = 273 K Mean '(C±C) = 0.002 A Ê R factor = 0.038 wR factor = 0.110 Data-to-parameter ratio = 15.0 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.

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Molecules of the title compound, C 16 H 16 N 2 O 3 S, are linked by N-HÁ Á ÁS hydrogen bonds to form centrosymmetric dimers [NÁ Á ÁS = 3.4501 (13) A ˚]. The N 0 -phenyl and N-phenyl rings are twisted by 52.7 (1) and 23.3 (1) , respectively, from the essentially planar -NHC( S)NC( O)-moiety.

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Single-crystal X-ray study T = 273 K Mean '(C±C) = 0.002 A Ê R factor = 0.039 wR factor = 0.105 Data-to-parameter ratio = 15.7 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.

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Single-crystal X-ray study T = 293 K Mean '(C±C) = 0.003 A Ê R factor = 0.045 wR factor = 0.125 Data-to-parameter ratio = 17.9 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.