Geometry & MOs

Info

ID:	327165
PubChem CID:	126689134
Reduced:	F2O2N5C26H29 (1)
Stoich.:	A2B2C5D26E29 (1)
Weight, g/mol:	431.232125
ΔH_f, kcal/mol:	-109.97
Dipole, Da:	4.24
IP(EA), eV:	-8.64(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[6-[3-(azetidin-1-yl)propoxy]pyridin-3-yl]-3-methyl-1-propan-2-ylimidazo[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)OCCCN5CCCC5)F)F)N(C1=O)C

DOS

IR

Vibrations