Geometry & MOs

Info

ID:	281361
PubChem CID:	103913759
Reduced:	NC12H17 (1)
Stoich.:	AB12C17 (1)
Weight, g/mol:	209.123821
ΔH_f, kcal/mol:	26.93
Dipole, Da:	1.58
IP(EA), eV:	-8.96(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-N-(2-ethylsulfanylethyl)-1-phenylethanamine

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)NC(C)C=C

DOS

IR

Vibrations