Geometry & MOs

Info

ID:	327170
PubChem CID:	126689143
Reduced:	F2O2N5C24H27 (1)
Stoich.:	A2B2C5D24E27 (1)
Weight, g/mol:	445.247775
ΔH_f, kcal/mol:	-106.85
Dipole, Da:	4.11
IP(EA), eV:	-8.67(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)N1C2=C(C=NC3=CC(=C(C=C32)C4=C(N=C(C=C4)OCCCN(C)C)F)F)N(C1=O)C

DOS

IR

Vibrations