Geometry & MOs

Info

ID:	321590
PubChem CID:	126666652
Reduced:	BrFON4H16C19 (1)
Stoich.:	ABCD4E16F19 (1)
Weight, g/mol:	255.117176
ΔH_f, kcal/mol:	33.02
Dipole, Da:	3.65
IP(EA), eV:	-9.24(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1R,3S)-3-fluorocyclopentyl]imidazo[4,5-c]quinoline

Drug info:

PubChemData

Smile

C1C[C@H](C[C@H]1N2C(=NC3=CN=C4C=CC(=CC4=C32)Br)CC5=NOC=C5)F

DOS

IR

Vibrations