Geometry & MOs

Info

ID:	429767
PubChem CID:	135169819
Reduced:	ON3F4H11C15 (1)
Stoich.:	AB3C4D11E15 (1)
Weight, g/mol:	420.95459
ΔH_f, kcal/mol:	-165.88
Dipole, Da:	5.93
IP(EA), eV:	-9.33(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(8-fluoroquinolin-6-yl)pyrrolo[2,3-b]pyridin-1-yl] thiohypoiodite

Drug info:

PubChemData

Smile

CC(=O)/C(=C/N)/C(=NC1=C2C=CC=C(C2=CN=C1)F)C(F)(F)F

DOS

IR

Vibrations