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- W1965894098 abstract "The He I photoelectron spectrum of thioformamide (HCSNH2) has been measured. On the basis of spectral features, CNDO/2 calculations, and sum rule considerations, the following assignments have been concluded. 1) Six ionization bands appearing below 17 eV correspond to six-p-type MOs and two bands in the region 17–20 eV correspond to s-type MOs. 2) The first ionization band is attributed to the highest occupied (in-plane) MO constructed mainly from the sulfur lone pair which is mixed to some extent with the σCN orbital. 3) The second and fourth bands are due to the out-of-plane MOs, mainly corresponding to the nitrogen lone pair and the πcs orbital, respectively. 4) The remaining p-type bands may be interpreted in terms of σCS, σCN, and πNH2 (pseudo pi) orbitals." @default.
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- W1965894098 date "1976-04-01" @default.
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- W1965894098 title "A Photoelectron Spectroscopic Study of Thioformamide" @default.
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- W1965894098 doi "https://doi.org/10.1246/bcsj.49.937" @default.
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