Geometry & MOs

Info

ID:	321630
PubChem CID:	126666702
Reduced:	FN6H19C21 (1)
Stoich.:	AB6C19D21 (1)
Weight, g/mol:	374.165523
ΔH_f, kcal/mol:	80.68
Dipole, Da:	1.67
IP(EA), eV:	-9.33(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2=NC3=CN=C4C=CC(=CC4=C3N2[C@H]5CC[C@H](C5)F)C#N

DOS

IR

Vibrations