화학공학소재연구정보센터
Journal of Physical Chemistry A, Vol.109, No.40, 9021-9027, 2005
Matrix infrared spectra and density functional theory calculations of molybdenum hydrides
Laser-ablated Mo atoms react with H-2 upon condensation in excess argon, neon, and hydrogen. The molybdenum hydrides MoH, MoH2, MoH4, and MoH6 are identified by isotopic substitution (H-2, D-2, HD, H-2 + D-2) and by comparison with vibrational frequencies calculated by density functional theory. The MoH2 molecule is bent, MoH4 is tetrahedral, and MoH6 appears to have the distorted trigonal prism structure.