In the asymmetric unit of the title nicotinonitrile derivative, C(23)H(21)BrN(2)O(4), there are two non-planar independent mol-ecules. The central pyridine ring makes dihedral angles of 9.05â (7) and 77.06â (7)°, respectively, with the 4-bromo-phenyl and 2,4,6-trimethoxy-phenyl rings in one mol-ecule, whereas the corresponding values are 5.96â (7) and 82.37â (7)° in the other. All the three meth-oxy groups are essentially in the plane of the attached benzene ring [C-O-C-C angles = 2.99â (19), 4.8â (2) and -6.2â (2)° in one mol-ecule, and 2.69â (18), 176.73â (15) and 1.3â (2)° in the other]. The eth-oxy group is slightly twisted in one mol-ecule [C-C-O-C = 173.84â (12)°], whereas it is coplanar with the pyridine ring in the other [C-C-O-C = -177.23â (13)°]. Weak intra-molecular C-Hâ¯N inter-actions generate S(5) ring motifs. In the crystal structure, the mol-ecules are linked by weak inter-molecular C-Hâ¯N and C-Hâ¯O inter-actions into a supra-molecular three-dimensional network in such a way that the nicotinonitrile units of neighboring mol-ecules are stacked in an anti-parallel manner along the c axis. The crystal is further stabilized by C-Hâ¯Ï inter-actions.
6-(4-Bromo-phen-yl)-2-eth-oxy-4-(2,4,6-trimethoxy-phen-yl)nicotinonitrile.
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作者:Chantrapromma Suchada, Fun Hoong-Kun, Suwunwong Thitipone, Padaki Mahesh, Isloor Arun M
| 期刊: | Acta Crystallographica Section E-Structure Reports Online | 影响因子: | 0.600 |
| 时间: | 2009 | 起止号: | 2009 Oct 31; 65(Pt 11):o2914-5 |
| doi: | 10.1107/S1600536809043943 | ||
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