Reactions of laser-ablated Fe, Co, and Ni with NO: Infrared spectra and density functional calculations of MNO+ and M(NO)(x) (M = Fe, Co, x=1-3; M = Ni, x=1, 2), and M(NO)(x)(-) (M = Co, Ni; x=1, 2)

Citation
Mf. Zhou et L. Andrews, Reactions of laser-ablated Fe, Co, and Ni with NO: Infrared spectra and density functional calculations of MNO+ and M(NO)(x) (M = Fe, Co, x=1-3; M = Ni, x=1, 2), and M(NO)(x)(-) (M = Co, Ni; x=1, 2), J PHYS CH A, 104(17), 2000, pp. 3915-3925
Citations number
48
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF PHYSICAL CHEMISTRY A
ISSN journal
10895639 → ACNP
Volume
104
Issue
17
Year of publication
2000
Pages
3915 - 3925
Database
ISI
SICI code
1089-5639(20000504)104:17<3915:ROLFCA>2.0.ZU;2-Y
Abstract
Laser-ablated iron, cobalt, and nickel atoms, cations, and electrons have b een reacted with NO molecules during condensation in excess neon and argon. The end-on bonded Fe(NO)(1-3), CO(NO)(1-3), and Ni(NO)(1-2) nitrosyls and side-bonded Fe-(eta(2)-NO), Co-(eta(2)-NO), and Ni-(eta(2)-NO) species are formed during sample deposition or on annealing. The FeNO+, CoNO+, and NiNO + mononitrosyl cations are also produced via metal cation reactions with NO . Evidence is also presented for the Ni(NO)(1,2)- and Co(NO)(1,2)- anions. The product absorptions are identified by isotopic substitution ((NO)-N-15- O-16, (NO)-N-15-O-18 and mixtures), electron trapping with added CCl4, and density functional calculations of isotopic frequencies. This work provides the first vibrational spectroscopic characterization of Fe, Co, and Ni nit rosyl cations and anions.