Geometry & MOs

Info

ID:	72426
PubChem CID:	48416164
Reduced:	NF2O4C20H21 (1)
Stoich.:	AB2C4D20E21 (1)
Weight, g/mol:	369.194008
ΔH_f, kcal/mol:	-229.61
Dipole, Da:	6.1
IP(EA), eV:	-8.91(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[(2,3-dimethylbenzoyl)amino]methyl]-3-(4-ethoxyphenyl)propanoate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)C2=C(C=C(C=C2)F)F)C(=O)OC

DOS

IR

Vibrations