Geometry & MOs

Info

ID:	403943
PubChem CID:	135062919
Reduced:	NC10H12 (2)
Stoich.:	AB10C12 (2)
Weight, g/mol:	475.88826
ΔH_f, kcal/mol:	67.13
Dipole, Da:	4.7
IP(EA), eV:	-8.19(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-diiodo-5-phenylmethoxy-1H-pyrrolo[3,2-b]pyridine

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)[N+]4=CN(C=[C-]4)CC5=CC=CC=C5

DOS

IR

Vibrations