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4,6-二叔丁基-2,8-二甲氧基-二苯并[b,d]呋喃

4,6-Di-tert-butyl-2,8-dimeth-oxy-dibenzo[b,d]furan.

作者信息

Chung Dayeon, Otgonbaatar Enkhzul, Son Seok Hwan, Chung Minchul, Kwak Chee-Hun

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Dec 1;67(Pt 12):o3356. doi: 10.1107/S1600536811048379. Epub 2011 Nov 19.

Abstract

In the title compound, C(22)H(28)O(3), the dihedral angle between the benzene rings is 3.47 (13)° and the five-membered furan ring is essentially planar with a largest deviation of 0.0052 (14) Å. The Csp(2)-Csp(2) bond length between the two benzene rings [1.443 (3) Å] is considerably shorter than those between the benzene and tertiary C atoms [1.538 (3) and 1.530 (3) Å], which are sp(2)-sp(3) hybridized. C-H⋯π inter-actions involving the furan and benzene rings are found in the crystal structure.

摘要

在标题化合物C₂₂H₂₈O₃中,苯环之间的二面角为3.47 (13)°,五元呋喃环基本呈平面状,最大偏差为0.0052 (14) Å。两个苯环之间的Csp²-Csp²键长[1.443 (3) Å]明显短于苯环与叔碳(均为sp²-sp³杂化)之间的键长[1.538 (3)和1.530 (3) Å]。晶体结构中存在涉及呋喃环和苯环的C-H⋯π相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9e20/3239001/9656c931836a/e-67-o3356-fig1.jpg

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