Geometry & MOs

Info

ID:	7085
PubChem CID:	71194
Reduced:	NCl2O2H9C13 (1)
Stoich.:	AB2C2D9E13 (1)
Weight, g/mol:	281.001034
ΔH_f, kcal/mol:	-48.72
Dipole, Da:	6.3
IP(EA), eV:	-9.19(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dichloroanilino)benzoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)O)NC2=C(C(=CC=C2)Cl)Cl

DOS

IR

Vibrations