Geometry & MOs

Info

ID:	247004
PubChem CID:	103066281
Reduced:	ClNS2C7H8 (1)
Stoich.:	ABC2D7E8 (1)
Weight, g/mol:	194.053214
ΔH_f, kcal/mol:	39.94
Dipole, Da:	1.85
IP(EA), eV:	-8.89(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-3-(3-methoxypropylsulfanyl)prop-1-ene

Drug info:

PubChemData

Smile

C=C(CSC1=NC=CS1)CCl

DOS

IR

Vibrations