Geometry & MOs

Info

ID:	262355
PubChem CID:	103288025
Reduced:	ClSO2C14H19 (1)
Stoich.:	ABC2D14E19 (1)
Weight, g/mol:	265.993506
ΔH_f, kcal/mol:	-97.14
Dipole, Da:	2.58
IP(EA), eV:	-9.02(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-2-(3-chloropropylsulfonylmethyl)benzene

Drug info:

PubChemData

Smile

CCCCC(C(=O)OC)SCC1=CC=CC=C1Cl

DOS

IR

Vibrations