Literature DB >> 22058979

2-(5,6-Dihydro-benzimidazo[1,2-c]quinazolin-6-yl)-5-methyl-phenol.

Naser Eltaher Eltayeb, Siang Guan Teoh, Madhukar Hemamalini, Hoong-Kun Fun.   

Abstract

In the title compound, C(21)H(17)N(3)O, the imidazole ring is essentially planar, with a maximum deviation of 0.009 (1) Å. The mol-ecule is disordered over two sites corresponding to a rotation of approximately 180° with a refined occupancy ratio of 0.9180 (14):0.0820 (14). The central pyrim-idine ring makes dihedral angles of 5.02 (5), 3.97 (5) and 6.28 (5)°, respectively, with the planes of the imidazole and the terminal phenyl rings for the major component; the values for the minor component are 5.8 (7), 5.0 (6) and 8.5 (6)°, respectively. Part of the observed planarity is accounted for in terms of an intra-molecular N-H⋯O hydrogen bond. In the crystal, mol-ecules of the major component are connected by O-H⋯N hydrogen bonds, forming supra-molecular chains along the c axis.

Entities:  

Year:  2011        PMID: 22058979      PMCID: PMC3200579          DOI: 10.1107/S1600536811032673

Source DB:  PubMed          Journal:  Acta Crystallogr Sect E Struct Rep Online        ISSN: 1600-5368


  6 in total

1.  DNA-nanotube artificial ion channels.

Authors:  C Chad Harrell; Punit Kohli; Zuzanna Siwy; Charles R Martin
Journal:  J Am Chem Soc       Date:  2004-12-08       Impact factor: 15.419

2.  A short history of SHELX.

Authors:  George M Sheldrick
Journal:  Acta Crystallogr A       Date:  2007-12-21       Impact factor: 2.290

3.  Aqua-[1,3-bis-(benzimidazol-2-yl)-2-oxapropane]-diethano-lmanganese(II) dipicrate ethanol disolvate.

Authors:  Tao Sun; Ke Li; Yulin Lai; Ruihuan Chen; Huilu Wu
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2010-08-04

4.  2-Meth-oxy-6-(6-methyl-1H-benzimid-azol-2-yl)phenol.

Authors:  Naser Eltaher Eltayeb; Siang Guan Teoh; Ching Kheng Quah; Hoong-Kun Fun; Rohana Adnan
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2009-06-17

5.  4-(5,6-Dihydro-benzimidazo[1,2-c]quinazolin-6-yl)benzene-1,3-diol dimethyl sulfoxide monosolvate.

Authors:  Naser Eltaher Eltayeb; Siang Guan Teoh; Chin Sing Yeap; Hoong-Kun Fun
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2011-06-18

6.  Structure validation in chemical crystallography.

Authors:  Anthony L Spek
Journal:  Acta Crystallogr D Biol Crystallogr       Date:  2009-01-20
  6 in total

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