Geometry & MOs

Info

ID:	321610
PubChem CID:	126666678
Reduced:	OF4N6H16C19 (1)
Stoich.:	AB4C6D16E19 (1)
Weight, g/mol:	289.09636
ΔH_f, kcal/mol:	-117.33
Dipole, Da:	6.21
IP(EA), eV:	-9.72(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-methyl-1,2-oxazol-3-yl)methyl]-3H-imidazo[4,5-c]quinoline-8-carbonitrile

Drug info:

PubChemData

Smile

C1COCCC1N2C(=NC3=CN=C4C=CC(=CC4=C32)F)CN5C=C(N=N5)C(F)(F)F

DOS

IR

Vibrations