Geometry & MOs

Info

ID:	321676
PubChem CID:	126666779
Reduced:	ON6H12C16 (1)
Stoich.:	AB6C12D16 (1)
Weight, g/mol:	368.144868
ΔH_f, kcal/mol:	116.37
Dipole, Da:	8.15
IP(EA), eV:	-9.0(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[1-(2,2-difluorocyclohexyl)imidazo[4,5-c]quinolin-2-yl]methyl]-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=NC2=CC(=C(C(=C2C3=C1NC=N3)N4C=CC=N4)C#N)OC

DOS

IR

Vibrations