Geometry & MOs

Info

ID:	327189
PubChem CID:	126689181
Reduced:	O3N6H24C32 (1)
Stoich.:	A3B6C24D32 (1)
Weight, g/mol:	463.238353
ΔH_f, kcal/mol:	112.12
Dipole, Da:	7.13
IP(EA), eV:	-8.63(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[2-fluoro-6-(3-pyrrolidin-1-ylpropoxy)pyridin-3-yl]-3-methyl-1-propan-2-ylimidazo[4,5-c]quinolin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C2=CC3=C(C(=CN3C(C#N)(C4=CC=CC=N4)C5=CC=CC=N5)C6=CC=C(C=C6)C(=O)OC)N=C2

DOS

IR

Vibrations