Geometry & MOs

Info

ID:

394308

PubChem CID:

135022746

Reduced:

SiO3C20H34 (1)

Stoich.:

AB3C20D34 (1)

Weight, g/mol:

388.152203

ΔHf, kcal/mol:

-171.32

Dipole, Da:

3.69

IP(EA), eV:

 -8.63(0.35)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl (1S,3R,7S,8R,13S,15R,16S)-5,15-dihydroxy-15-methyl-2,11-dioxo-7-prop-1-en-2-yl-12-oxatetracyclo[8.5.1.03,8.013,16]hexadeca-4,9-diene-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)O[C@@H](CCCOCC1=CC=C(C=C1)OC)C=C

DOS

IR

Vibrations