Geometry & MOs

Info

ID:	261448
PubChem CID:	103234527
Reduced:	ClNO3C12H16 (1)
Stoich.:	ABC3D12E16 (1)
Weight, g/mol:	270.07712
ΔH_f, kcal/mol:	-121.14
Dipole, Da:	3.54
IP(EA), eV:	-8.51(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-acetamido-3-(2-chloroanilino)propanoate

Drug info:

PubChemData

Smile

CCOC(=O)COCCNC1=CC=CC=C1Cl

DOS

IR

Vibrations