Geometry & MOs

Info

ID:	197024
PubChem CID:	78910078
Reduced:	ClN2H13C15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	267.1987
ΔH_f, kcal/mol:	52.57
Dipole, Da:	6.6
IP(EA), eV:	-8.7(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylphenyl)-N-[(4-propan-2-ylphenyl)methyl]ethanamine

Drug info:

PubChemData

Smile

CC1=CN2C(=C(N=C2C=C1)C3=CC(=CC=C3)Cl)C

DOS

IR

Vibrations