Geometry & MOs

Info

ID:	272548
PubChem CID:	103744991
Reduced:	ClON4H9C10 (1)
Stoich.:	ABC4D9E10 (1)
Weight, g/mol:	266.020668
ΔH_f, kcal/mol:	31.6
Dipole, Da:	2.68
IP(EA), eV:	-9.47(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloropyridin-3-yl)-4-nitro-1H-pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

C1=CN(N=C1)CC(=O)NC2=C(C=CN=C2)Cl

DOS

IR

Vibrations