Geometry & MOs

Info

ID:	393428
PubChem CID:	135020553
Reduced:	O5C21H30 (1)
Stoich.:	A5B21C30 (1)
Weight, g/mol:	403.163102
ΔH_f, kcal/mol:	-216.38
Dipole, Da:	2.56
IP(EA), eV:	-8.9(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dimethoxyphenyl)-2-oxo-N-[2-(3,4,5-trimethoxyphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C(CCC=C)(CCC1=C2CCCCC2=CO1)C(=O)OCC

DOS

IR

Vibrations