Geometry & MOs

Info

ID:	20263
PubChem CID:	582827
Reduced:	SO2C9H14 (1)
Stoich.:	AB2C9D14 (1)
Weight, g/mol:	186.071451
ΔH_f, kcal/mol:	-66.82
Dipole, Da:	6.95
IP(EA), eV:	-10.6(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methylbutyl)thiophene 1,1-dioxide

Drug info:

PubChemData

Smile

CC(C)CCC1=CS(=O)(=O)C=C1

DOS

IR

Vibrations