Geometry & MOs

Info

ID:	143879
PubChem CID:	53274411
Reduced:	ClN2C17H17 (1)
Stoich.:	AB2C17D17 (1)
Weight, g/mol:	318.069054
ΔH_f, kcal/mol:	49.54
Dipole, Da:	1.39
IP(EA), eV:	-8.44(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dichlorophenyl)-N-(1H-indol-4-ylmethyl)ethanamine

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CCNCC2=C3C=CNC3=CC=C2)Cl

DOS

IR

Vibrations