The structure of nitrobenzene and the interpretation of the vibrational frequencies of the CNO2 moiety on the basis of ab initio calculations

Systematic ab initio gradient calculation of molecular geometries, force constants, and dipole moment derivatives

Péter Pulay, Géza Fogarasi, Frank Pang et al. · Journal of the American Chemical Society · 1979 · 2.1K citations

Natural Sciences, Chemistry, Physics +11

The vibrational spectra of benzene derivatives—I

J.H.S. Green, W. Kynaston, A. S. Lindsey · Spectrochimica Acta · 1961 · 159 citations

Natural Sciences, Chemistry, Physics +14

The vibrational spectra and assignments of nitrobenzene, phenyl isocyanate, phenyl isothiocyanate, thionylaniline and anisole

C. V. Stephenson, W. C. Coburn, W. S. Wilcox · Spectrochimica Acta · 1961 · 138 citations

Natural Sciences, Chemistry, Physics +16

Raman spectra and barriers to internal rotation: biphenyl and nitrobenzene

L. A. Carreira, T. G. Towns · Journal of Molecular Structure · 1977 · 134 citations

Natural Sciences, Chemistry, Physics +14

Molecular structure of nitrobenzene in the planar and orthogonal conformations

Aldo Domenicano, G. SCHULTZ, Istv�n Hargittai et al. · Structural Chemistry · 1990 · 132 citations

Natural Sciences, Chemistry, Crystal Structure +12