Geometry & MOs

Info

ID:	72425
PubChem CID:	48416163
Reduced:	NO4C19H29 (1)
Stoich.:	AB4C19D29 (1)
Weight, g/mol:	377.143864
ΔH_f, kcal/mol:	-194.66
Dipole, Da:	3.63
IP(EA), eV:	-8.73(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations