Geometry & MOs

Info

ID:	429307
PubChem CID:	135169276
Reduced:	FON4H19C21 (1)
Stoich.:	ABC4D19E21 (1)
Weight, g/mol:	402.96402
ΔH_f, kcal/mol:	-3.92
Dipole, Da:	2.76
IP(EA), eV:	-8.98(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-quinolin-6-ylpyrrolo[2,3-b]pyridin-1-yl) thiohypoiodite

Drug info:

PubChemData

Smile

CCCCNC(=O)C1=CC2=C(NC=C2C3=CC(=C4C(=C3)C=CC=N4)F)N=C1

DOS

IR

Vibrations