Geometry & MOs

Info

ID:	250199
PubChem CID:	103094815
Reduced:	ClO3N4H9C12 (1)
Stoich.:	AB3C4D9E12 (1)
Weight, g/mol:	304.109089
ΔH_f, kcal/mol:	0.18
Dipole, Da:	5.86
IP(EA), eV:	-9.47(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloropyridin-2-yl)-2-(methylamino)-6-propylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)[N+](=O)[O-])N)C(=O)NC2=C(C=CC=N2)Cl

DOS

IR

Vibrations