Geometry & MOs

Info

ID:	327389
PubChem CID:	126689774
Reduced:	S3O4C54H76 (1)
Stoich.:	A3B4C54D76 (1)
Weight, g/mol:	379.200825
ΔH_f, kcal/mol:	-169.68
Dipole, Da:	2.56
IP(EA), eV:	-8.14(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[6-(3-aminopropoxy)pyridin-3-yl]-1-propan-2-yl-5,9b-dihydro-3H-imidazo[4,5-c]quinolin-2-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC1=CC2=C(S1)C3=C(C2(OCC)OCC)C=CC4=C3C=CC5=C4C6=C(C5(OCC)OCC)C7=C(S6)C=C(S7)CCCCCCCCCCCC

DOS

IR

Vibrations