Geometry & MOs

Info

ID:	247197
PubChem CID:	103068634
Reduced:	SN3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	261.014576
ΔH_f, kcal/mol:	28.41
Dipole, Da:	2.89
IP(EA), eV:	-8.48(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,4-dichlorophenyl)sulfanylmethyl]-N-methylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CC1=C(N=C(N=C1C)SCC(=C)CNC)C

DOS

IR

Vibrations