Geometry & MOs

Info

ID:	264097
PubChem CID:	103427908
Reduced:	INOCl2H8C15 (1)
Stoich.:	ABCD2E8F15 (1)
Weight, g/mol:	298.100354
ΔH_f, kcal/mol:	32.39
Dipole, Da:	3.12
IP(EA), eV:	-9.17(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4,6-dichloroindol-1-yl)ethyl]-2-methylbutan-2-amine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)I)C(=O)C2=CNC3=C2C(=CC(=C3)Cl)Cl

DOS

IR

Vibrations