Geometry & MOs

Info

ID:	386631
PubChem CID:	134982405
Reduced:	OSH10C11 (1)
Stoich.:	ABC10D11 (1)
Weight, g/mol:	489.272653
ΔH_f, kcal/mol:	-5.65
Dipole, Da:	4.48
IP(EA), eV:	-9.44(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-1-[(2S)-2-[(3,4-dimethoxyphenyl)methoxy]-2-[(2R,5R,6R)-2-methoxy-5,6-dimethyl-4-methylideneoxan-2-yl]acetyl]-5-propan-2-ylpyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1C=C(C(=O)S1)C2=CC=CC=C2

DOS

IR

Vibrations