Geometry & MOs

Info

ID:	28220
PubChem CID:	826382
Reduced:	NOC19H23 (1)
Stoich.:	ABC19D23 (1)
Weight, g/mol:	229.092521
ΔH_f, kcal/mol:	0.09
Dipole, Da:	2.82
IP(EA), eV:	-8.81(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-phenylsulfanylphenyl)ethanamine

Drug info:

PubChemData

Smile

CN(C)CCC(=O)[C@H](CC1=CC=CC=C1)C2=CC=CC=C2

DOS

IR

Vibrations