Geometry & MOs

Info

ID:	247176
PubChem CID:	103068485
Reduced:	NSC15H23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	207.108171
ΔH_f, kcal/mol:	11.69
Dipole, Da:	1.96
IP(EA), eV:	-8.47(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methylphenyl)methylsulfanylmethyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CSCC(=C)CNC(C)C

DOS

IR

Vibrations