Geometry & MOs

Info

ID:	341294
PubChem CID:	127263987
Reduced:	N2Cl3C11H15 (1)
Stoich.:	A2B3C11D15 (1)
Weight, g/mol:	330.003809
ΔH_f, kcal/mol:	-49.39
Dipole, Da:	1.64
IP(EA), eV:	-8.95(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4,6-dichloro-2-methyl-1H-indol-3-yl)propan-1-amine;dihydrochloride

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)Cl)C(=CN2)CCCN.Cl.Cl

DOS

IR

Vibrations