Geometry & MOs

Info

ID:	72473
PubChem CID:	48416214
Reduced:	NO6C22H27 (1)
Stoich.:	AB6C22D27 (1)
Weight, g/mol:	375.123736
ΔH_f, kcal/mol:	-221.03
Dipole, Da:	3.8
IP(EA), eV:	-8.76(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations