Xanthine

2D Structure
MF: C5H4N4O2
MW: 152.11 g/mol
IUPAC Name: 3,7-dihydropurine-2,6-dione
Calculated IR and Raman Spectra of Xanthine Calculated IR and Raman Spectra of Xanthine Calculated IR and Raman Spectra of Xanthine Calculated IR and Raman Spectra of Xanthine Calculated IR and Raman Spectra of Xanthine Calculated IR and Raman Spectra of Xanthine

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 1188, Xanthine. https://pubchem.ncbi.nlm.nih.gov/compound/Xanthine. Accessed Apr. 17, 2022.