Geometry & MOs

Info

ID:	205358
PubChem CID:	80091685
Reduced:	O2N3C13H13 (1)
Stoich.:	A2B3C13D13 (1)
Weight, g/mol:	242.105528
ΔH_f, kcal/mol:	-28.9
Dipole, Da:	5.11
IP(EA), eV:	-9.25(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,6-dimethylpyridin-3-yl)amino]benzoic acid

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)NC(=O)C2=CC(=CN=C2)O)C

DOS

IR

Vibrations