Geometry & MOs

Info

ID:	338995
PubChem CID:	127260006
Reduced:	SO4C14H18 (1)
Stoich.:	AB4C14D18 (1)
Weight, g/mol:	326.064651
ΔH_f, kcal/mol:	-117.35
Dipole, Da:	5.57
IP(EA), eV:	-9.82(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methoxy-2-methyl-3-thiophen-2-ylpropan-2-yl) benzenesulfonate

Drug info:

PubChemData

Smile

CCC1(COC1C=C)COS(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations