Geometry & MOs

Info

ID:	272931
PubChem CID:	103767950
Reduced:	ClNO3C14H18 (1)
Stoich.:	ABC3D14E18 (1)
Weight, g/mol:	213.055656
ΔH_f, kcal/mol:	-155.39
Dipole, Da:	4.33
IP(EA), eV:	-8.7(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(2-chloro-5-methylanilino)acetate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)Cl)NC(=O)CC(C)(C)CC(=O)O

DOS

IR

Vibrations