Geometry & MOs

Info

ID:	199765
PubChem CID:	79293638
Reduced:	ClN4H13C14 (1)
Stoich.:	AB4C13D14 (1)
Weight, g/mol:	291.150225
ΔH_f, kcal/mol:	71.15
Dipole, Da:	3.82
IP(EA), eV:	-9.35(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-3-(3-ethylcyclohexyl)-7-methylimidazo[4,5-b]pyridine

Drug info:

PubChemData

Smile

CC1=C2C(=NC=C1)N(C(=N2)CCl)CC3=CC=CC=N3

DOS

IR

Vibrations