Estradiol

2D Structure
MF: C18H24O2
MW: 272.4 g/mol
IUPAC Name: (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Calculated IR and Raman Spectra of Estradiol Calculated IR and Raman Spectra of Estradiol Calculated IR and Raman Spectra of Estradiol Calculated IR and Raman Spectra of Estradiol Calculated IR and Raman Spectra of Estradiol Calculated IR and Raman Spectra of Estradiol

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 5757, Estradiol. https://pubchem.ncbi.nlm.nih.gov/compound/Estradiol. Accessed Apr. 18, 2022.