Geometry & MOs

Info

ID:	72438
PubChem CID:	48416176
Reduced:	NO5C21H27 (1)
Stoich.:	AB5C21D27 (1)
Weight, g/mol:	376.118985
ΔH_f, kcal/mol:	-202.11
Dipole, Da:	3.35
IP(EA), eV:	-8.69(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)C2=C(OC(=C2C)C)C)C(=O)OC

DOS

IR

Vibrations