Phenyl isocyanate

2D Structure
MF: C7H5NO
MW: 119.12 g/mol
IUPAC Name: isocyanatobenzene
Calculated IR and Raman Spectra of Phenyl isocyanate Calculated IR and Raman Spectra of Phenyl isocyanate Calculated IR and Raman Spectra of Phenyl isocyanate Calculated IR and Raman Spectra of Phenyl isocyanate Calculated IR and Raman Spectra of Phenyl isocyanate Calculated IR and Raman Spectra of Phenyl isocyanate

Calculation


Reference

[1] Alex A. Granovsky, Firefly version 8, www http://classic.chem.msu.su/gran/firefly/index.html
[2] M.W.Schmidt, K.K.Baldridge, J.A.Boatz, S.T.Elbert, M.S.Gordon, J.H.Jensen, S.Koseki, N.Matsunaga, K.A.Nguyen, S.Su, T.L.Windus, M.Dupuis, J.A.Montgomery J.Comput.Chem. 14, 1347-1363 (1993)
[3] H.Yoshida, K.Takeda, J.Okayama, A.Ehara and H.Matsuura, J. Phys. Chem. A 106, 3580 (2002)
[4] National Center for Biotechnology Information. PubChem Compound Summary for CID 7672, Phenyl isocyanate. https://pubchem.ncbi.nlm.nih.gov/compound/Phenyl isocyanate. Accessed Apr. 18, 2022.