Geometry & MOs

Info

ID:	55119
PubChem CID:	17389786
Reduced:	ClON2C11H17 (1)
Stoich.:	ABC2D11E17 (1)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	-50.08
Dipole, Da:	3.62
IP(EA), eV:	-9.51(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(3-methylphenyl)-1H-indol-2-yl]butan-1-amine;oxalic acid

Drug info:

PubChemData

Smile

C1=CN=CC=C1C(=O)CCCCCN.Cl

DOS

IR

Vibrations