Geometry & MOs

Info

ID:	327930
PubChem CID:	126691410
Reduced:	N3O4F6C35H37 (1)
Stoich.:	A3B4C6D35E37 (1)
Weight, g/mol:	343.14331
ΔH_f, kcal/mol:	-409.95
Dipole, Da:	8.53
IP(EA), eV:	-8.6(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@H]1[C@H](OCN1CC2=C(C(=CC(=N2)N3CCC3)C)C4=C(C=CC(=C4)C5CC(C5)C(=O)OC)OC)C6=CC(=CC(=C6)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations