Geometry & MOs

Info

ID:	56852
PubChem CID:	22394400
Reduced:	NC4H9 (2)
Stoich.:	AB4C9 (2)
Weight, g/mol:	442.85154
ΔH_f, kcal/mol:	-11.71
Dipole, Da:	2.48
IP(EA), eV:	-8.86(2.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,7-diiodo-4-methoxy-1H-indole-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C1CCN(CC1)N

DOS

IR

Vibrations