Geometry & MOs

Info

ID:	271783
PubChem CID:	103691509
Reduced:	ClSO2C6H13 (1)
Stoich.:	ABC2D6E13 (1)
Weight, g/mol:	178.058299
ΔH_f, kcal/mol:	-109.3
Dipole, Da:	4.07
IP(EA), eV:	-10.8(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(tert-butylsulfanylmethyl)-3-chloroprop-1-ene

Drug info:

PubChemData

Smile

CC(C)CCS(=O)(=O)CCl

DOS

IR

Vibrations