Geometry & MOs

Info

ID:	247134
PubChem CID:	103068054
Reduced:	FNSC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	213.037898
ΔH_f, kcal/mol:	-32.22
Dipole, Da:	3.11
IP(EA), eV:	-8.72(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chlorophenyl)sulfanylmethyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)NCC(=C)CSC1=CC=CC=C1F

DOS

IR

Vibrations