Geometry & MOs

Info

ID:	327810
PubChem CID:	126691095
Reduced:	ClO2N4H19C20 (1)
Stoich.:	AB2C4D19E20 (1)
Weight, g/mol:	375.149538
ΔH_f, kcal/mol:	29.99
Dipole, Da:	4.2
IP(EA), eV:	-9.2(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1S,3R)-3-fluorocyclopentyl]-2-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-c]quinoline-8-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CC2=NC3=CN=C4C=CC(=CC4=C3N2C5CCOCC5)Cl

DOS

IR

Vibrations