Geometry & MOs

Info

ID:	232920
PubChem CID:	87577683
Reduced:	SCl2O2C7H12 (1)
Stoich.:	AB2C2D7E12 (1)
Weight, g/mol:	499.096264
ΔH_f, kcal/mol:	-94.08
Dipole, Da:	5.21
IP(EA), eV:	-10.99(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)CC1CC1(S(=O)(=O)Cl)Cl

DOS

IR

Vibrations