The nu(3) infrared spectrum of the He-NH4+ complex

被引:38
作者
Dopfer, O
Nizkorodov, SA
Meuwly, M
Bieske, EJ
Maier, JP
机构
[1] Inst. für Physikalische Chemie, Universität Basel, CH-4056 Basel
[2] School of Chemistry, University of Melbourne, Parkville
关键词
D O I
10.1016/0009-2614(96)00919-0
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The mid-infrared spectrum of the ionic complex He-NH4+ has been recorded in the vicinity of the triply degenerate nu(3) (t(2)) vibration of the free ammonium ion. Apart from a small blue shift (approximate to 0.7 cm(-1)), the spectrum of the complex closely resembles that of the monomer. Ab initio calculations predict a vertex-bound minimum structure with an intermolecular well depth D-e approximate to 150 cm(-1), a center-of-mass separation of R(e) approximate to 3.17 Angstrom and barriers for internal rotation less than 30 cm(-1).
引用
收藏
页码:545 / 550
页数:6
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