Geometry & MOs

Info

ID:	285933
PubChem CID:	104138694
Reduced:	N2O3C14H18 (1)
Stoich.:	A2B3C14D18 (1)
Weight, g/mol:	271.132077
ΔH_f, kcal/mol:	-103.06
Dipole, Da:	5.95
IP(EA), eV:	-8.85(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methylpyridin-3-yl)amino]-6-propan-2-ylpyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=C1)C(=O)O)N2CC3CCC(C2)O3

DOS

IR

Vibrations