Geometry & MOs

Info

ID:	325236
PubChem CID:	126682210
Reduced:	ClON5C23H24 (1)
Stoich.:	ABC5D23E24 (1)
Weight, g/mol:	328.089102
ΔH_f, kcal/mol:	42.74
Dipole, Da:	5.81
IP(EA), eV:	-9.12(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[8-chloro-1-(3-fluorocyclopentyl)imidazo[4,5-c]quinolin-2-yl]acetonitrile

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@H](CCO1)N2C(=NC3=CN=C4C=CC(=CC4=C32)Cl)CC5=NN6CCCC6=C5

DOS

IR

Vibrations