Geometry & MOs

Info

ID:	263613
PubChem CID:	103383159
Reduced:	O2S2N5C11H21 (1)
Stoich.:	A2B2C5D11E21 (1)
Weight, g/mol:	215.069477
ΔH_f, kcal/mol:	-63.27
Dipole, Da:	4.49
IP(EA), eV:	-8.62(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-oxo-N-pyridin-2-yl-1H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CCNC2=C(C(=NS2)N)S(=O)(=O)C

DOS

IR

Vibrations