Geometry & MOs

Info

ID:	199735
PubChem CID:	79289075
Reduced:	SO3N4C10H10 (1)
Stoich.:	AB3C4D10E10 (1)
Weight, g/mol:	352.97307
ΔH_f, kcal/mol:	-66.74
Dipole, Da:	7.04
IP(EA), eV:	-8.9(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromo-3-fluorophenyl)-2-(2-chloroethyl)imidazo[4,5-c]pyridine

Drug info:

PubChemData

Smile

C1=CC2=C(N=C1)N(C(=N2)SCC(=O)O)CC(=O)N

DOS

IR

Vibrations