Geometry & MOs

Info

ID:	250081
PubChem CID:	103094011
Reduced:	ClN2O4C11H11 (1)
Stoich.:	AB2C4D11E11 (1)
Weight, g/mol:	277.025419
ΔH_f, kcal/mol:	-140.36
Dipole, Da:	4.62
IP(EA), eV:	-9.52(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-chloropyridin-2-yl)carbamoyl]pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CC(OC1C(=O)NC2=C(C=CC=N2)Cl)C(=O)O

DOS

IR

Vibrations