Geometry & MOs

Info

ID:	199779
PubChem CID:	79294589
Reduced:	ClSN3C15H16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	289.09819
ΔH_f, kcal/mol:	58.34
Dipole, Da:	2.57
IP(EA), eV:	-9.08(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-chloroethyl)-3-[1-(5-methylfuran-2-yl)ethyl]imidazo[4,5-b]pyridine

Drug info:

PubChemData

Smile

CC(CC1=CSC=C1)N2C(=NC3=C2N=CC=C3)CCCl

DOS

IR

Vibrations