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. 2010 Aug 4;66(Pt 9):o2219.
doi: 10.1107/S1600536810030072.

4,5-Dimethyl-1,2-diphenyl-1H-imidazole monohydrate

4,5-Dimethyl-1,2-diphenyl-1H-imidazole monohydrate

P Gayathri et al. Acta Crystallogr Sect E Struct Rep Online. .

Abstract

In the title compound, C(17)H(16)N(2)·H(2)O, the imidazole ring is essentially planar [maximum deviation = 0.0037 (7) Å]. The imidazole ring makes dihedral angles of 80.74 (7) and 41.62 (7)° with the phenyl rings attached to the N and C atoms, respectively. The dihedral angle between the two phenyl rings is 75.83 (8)°. Inter-molecular O-H⋯N and O-H⋯O hydrogen bonds are found in the crystal structure.

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Figures

Fig. 1.
Fig. 1.
The molecular structure of the title compound, showing the atom-numbering scheme and displacement ellipsoids drawn at the 30% probability level. H atoms are shown as small spheres of arbitrary radius.
Fig. 2.
Fig. 2.
The packing of the title compound, viewed down the c axis. Dashed lines indicate hydrogen bonds. H atoms not involved in hydrogen bonding have been omitted.

References

    1. Burla, M. C., Caliandro, R., Camalli, M., Carrozzini, B., Cascarano, G. L., De Caro, L., Giacovazzo, C., Polidori, G. & Spagna, R. (2005). J. Appl. Cryst.38, 381–388.
    1. Farrugia, L. J. (1997). J. Appl. Cryst.30, 565.
    1. Gayathri, P., Jayabharathi, J., Saravanan, K., Thiruvalluvar, A. & Butcher, R. J. (2010a). Acta Cryst. E66, o1791. - PMC - PubMed
    1. Gayathri, P., Jayabharathi, J., Srinivasan, N., Thiruvalluvar, A. & Butcher, R. J. (2010b). Acta Cryst. E66, o1703. - PMC - PubMed
    1. Oxford Diffraction (2010). CrysAlis PRO Oxford Diffraction Ltd, Yarnton, England.