High resolution molecular beam electronic spectroscopy has been used to obtain new experimental data on trans-formanilide first singlet electronic excited state. Experimental information was compared with ab initio calculations at different level of theory. A more clear understanding of trans-formanilide excited state properties came out in a comparison to the closely related aniline molecule.
Trans-formanilide: on the properties of the S1 state from high resolution electronic spectroscopy and ab initio calculations / M. Pasquini; N. Schiccheri; G. Pietraperzia; M. Becucci. - In: CHEMICAL PHYSICS LETTERS. - ISSN 0009-2614. - STAMPA. - 475:(2009), pp. 30-33. [10.1016/j.cplett.2009.05.020]
Trans-formanilide: on the properties of the S1 state from high resolution electronic spectroscopy and ab initio calculations
PASQUINI, MASSIMILIANO;SCHICCHERI, NICOLA;PIETRAPERZIA, GIANGAETANO;BECUCCI, MAURIZIO
2009
Abstract
High resolution molecular beam electronic spectroscopy has been used to obtain new experimental data on trans-formanilide first singlet electronic excited state. Experimental information was compared with ab initio calculations at different level of theory. A more clear understanding of trans-formanilide excited state properties came out in a comparison to the closely related aniline molecule.
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