Geometry & MOs

Info

ID:	200817
PubChem CID:	79448357
Reduced:	NSCl2C15H17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	287.144077
ΔH_f, kcal/mol:	8.78
Dipole, Da:	1.72
IP(EA), eV:	-9.35(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chlorophenyl)-3-phenyl-N-propylpropan-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(CC2=CN=C(S2)C)(CCl)CCl

DOS

IR

Vibrations