Geometry & MOs

Info

ID:	25070
PubChem CID:	618441
Reduced:	IN2H5C7 (1)
Stoich.:	AB2C5D7 (1)
Weight, g/mol:	243.94975
ΔH_f, kcal/mol:	80.42
Dipole, Da:	5.21
IP(EA), eV:	-8.64(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-iodo-7H-pyrrolo[2,3-b]pyridine

Drug info:

PubChemData

Smile

C1=CNC2=NC=C(C2=C1)I

DOS

IR

Vibrations