Geometry & MOs

Info

ID:	208503
PubChem CID:	80538203
Reduced:	ClNO5C13H14 (1)
Stoich.:	ABC5D13E14 (1)
Weight, g/mol:	289.027249
ΔH_f, kcal/mol:	-188.94
Dipole, Da:	4.39
IP(EA), eV:	-9.12(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2,4-dichlorobenzoyl)amino]-2-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(CCNC(=O)C1=CC2=C(C(=C1)Cl)OCO2)C(=O)O

DOS

IR

Vibrations