Choi Hong Dae, Seo Pil Ja, Son Byeng Wha, Lee Uk
Acta Crystallogr Sect E Struct Rep Online. 2010 Jun 16;66(Pt 7):o1680. doi: 10.1107/S1600536810022397.
In the title compound, C(16)H(12)FIO(2)S, the O atom and the methyl group of the methyl-sulfinyl substituent lie on opposite sides of the plane through the benzofuran fragment. The 4-fluoro-phenyl ring is rotated slightly out of the benzofuran plane, as indicated by the dihedral angle of 7.43 (6)°. In the crystal structure, pairs of short I⋯O [3.074 (2) Å] contacts link the mol-ecules into centrosymmetric dimers. These dimers are further linked via aromatic π-π inter-actions between the benzene and the 4-fluoro-phenyl rings of neighbouring mol-ecules [centroid-centroid distance = 3.617 (3) Å].
在标题化合物C(16)H(12)FIO(2)S中,甲基亚砜取代基的O原子和甲基位于通过苯并呋喃片段的平面的相对两侧。4-氟苯环略微偏离苯并呋喃平面,二面角为7.43 (6)°。在晶体结构中,短的I⋯O [3.074 (2) Å]接触对将分子连接成中心对称的二聚体。这些二聚体通过相邻分子的苯环和4-氟苯环之间的芳香π-π相互作用进一步连接[质心-质心距离 = 3.617 (3) Å]。