Literature DB >> 20048427

Hydrogen-bond motifs in N-monosubstituted derivatives of barbituric acid: 5-allyl-5-isopropyl-1-methylbarbituric acid (enallylpropymal) and 1,5-di(but-2-enyl)-5-ethylbarbituric acid.

Thomas Gelbrich1, Neslihan Zencirci, Ulrich J Griesser.   

Abstract

Both title structures exhibit essentially planar barbiturate rings. The crystal structure of enallylpropymal (5-allyl-5-isopropyl-1-methylbarbituric acid), C(11)H(16)N(2)O(3), is composed of centrosymmetric N-H...O hydrogen-bonded dimers, while 1,5-di(but-2-enyl)-5-ethylbarbituric acid, C(14)H(20)N(2)O(3), forms N-H...O hydrogen-bonded helical chains. Each of the ten known crystal structures of closely related N-monosubstituted derivatives of barbituric acid displays one of the fundamental N-H...O hydrogen-bonded motifs of the two title structures, i.e. either a dimer or a chain.

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Year:  2009        PMID: 20048427     DOI: 10.1107/S0108270109054249

Source DB:  PubMed          Journal:  Acta Crystallogr C        ISSN: 0108-2701            Impact factor:   1.172


  3 in total

1.  Crystal polymorphs of barbital: news about a classic polymorphic system.

Authors:  Neslihan Zencirci; Ulrich J Griesser; Thomas Gelbrich; David C Apperley; Robin K Harris
Journal:  Mol Pharm       Date:  2013-12-11       Impact factor: 4.939

2.  Tetra-gonal polymorph of 5,5-dichloro-barbituric acid.

Authors:  Thomas Gelbrich; Denise Rossi; Ulrich J Griesser
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2011-12-23

3.  Crystal structure of the α-racemate of methohexital.

Authors:  Thomas Gelbrich; Ulrich J Griesser
Journal:  Acta Crystallogr E Crystallogr Commun       Date:  2015-01-24
  3 in total

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