Geometry & MOs

Info

ID:	206526
PubChem CID:	80264428
Reduced:	OSN2C13H14 (1)
Stoich.:	ABC2D13E14 (1)
Weight, g/mol:	287.115758
ΔH_f, kcal/mol:	-6.43
Dipole, Da:	2.45
IP(EA), eV:	-8.52(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethoxyanilino)-4-methylbenzoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)NCC2=CC=CS2)N

DOS

IR

Vibrations