Geometry & MOs

Info

ID:	396410
PubChem CID:	135028315
Reduced:	OC12H20 (1)
Stoich.:	AB12C20 (1)
Weight, g/mol:	332.125988
ΔH_f, kcal/mol:	-34.28
Dipole, Da:	1.33
IP(EA), eV:	-8.77(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S,3S)-2-hydroxy-3-(2-hydroxy-4,6-dimethoxyphenyl)-3-phenylpropanoate

Drug info:

PubChemData

Smile

CCO/C/1=C/C(C/C=C\CC1)(C)C

DOS

IR

Vibrations