Geometry & MOs

Info

ID:	282044
PubChem CID:	103914739
Reduced:	OCl2N2C13H18 (1)
Stoich.:	AB2C2D13E18 (1)
Weight, g/mol:	243.058155
ΔH_f, kcal/mol:	-46.74
Dipole, Da:	1.91
IP(EA), eV:	-9.26(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2,3-dichlorophenyl)ethyl]-2-methylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CCN(C)C(=O)CNC(C)C1=C(C(=CC=C1)Cl)Cl

DOS

IR

Vibrations