TAKEO SOEJIMA, MOTOKI NAKASHIMA, SEIKI IKEDA AND KEIICHI TANAKA, Department of Chemistry, Faculty of Science, Kyushu University, Hakozaki, Higashiku, Fukuoka, 812-8581 JAPAN.
Rovibrational transitions of the 1 band (N-O stretch) of CoNO produced by the ultraviolet photolysis of Co(CO)3NO were observed in the 1775-1800 cm-1 region by time resolved infrared diode laser spectroscopy. In total, 35 absorption lines were assigned to the 1 fundamental band, and their J quantum numbers were determined by a simultaneous analysis with millimeter-wave spectroscopy. Hotband lines originated from the 2 (bending), 2 2, and 3 (Co-N stretch) vibrationally excited states were also observed. Molecular constants, including the band origin 0 1796.22371(49) cm-1, the rotational constant B_0 4669.7578(29) MHz, and the vibration rotation constant 1 31.325(28) MHz, were derived from the observed spectrum. The equilibrium rotational constant Be (4676.949(51) MHz) was determined with the 1 value derived in the present study and the 2 and 3 values reported by the millimeter-wave spectroscopya. The equilibrium bond-length r_Co-N was calculated to be 1.583 Å assuming r_NO = 1.182 Å by ab initio calculation. The absorption lines for the 1 + 2 2 and 1 + 2 2 2 2 bands were split into two components due to the l=2 interaction. The electronic ground state of CoNO was confirmed to be 1 + by this infrared study as reported by our previous millimeter-wave spectroscopya.