Geometry & MOs

Info

ID:	339329
PubChem CID:	127261163
Reduced:	SO4C12H16 (1)
Stoich.:	AB4C12D16 (1)
Weight, g/mol:	384.103145
ΔH_f, kcal/mol:	-142.86
Dipole, Da:	7.47
IP(EA), eV:	-9.58(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-methyl-2-(4-phenoxyphenoxy)benzenesulfonate

Drug info:

PubChemData

Smile

CCOS(=O)(=O)C1=C(C=C(C=C1)C)OCC=C

DOS

IR

Vibrations