Geometry & MOs

Info

ID:	149868
PubChem CID:	53789547
Reduced:	NO2S2H9C11 (1)
Stoich.:	AB2C2D9E11 (1)
Weight, g/mol:	239.1674
ΔH_f, kcal/mol:	-19.22
Dipole, Da:	4.96
IP(EA), eV:	-9.17(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-1-(4-methylphenyl)propan-2-amine

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)SC(=N2)SC=CC(=O)O

DOS

IR

Vibrations