Geometry & MOs

Info

ID:	338341
PubChem CID:	127259033
Reduced:	SO2H16C20 (1)
Stoich.:	AB2C16D20 (1)
Weight, g/mol:	226.066365
ΔH_f, kcal/mol:	-12.77
Dipole, Da:	3.08
IP(EA), eV:	-8.43(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methoxy-1-phenylsulfanylethyl) acetate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC(=C(C=C1)C2=CC=CC=C2)SC3=CC=CC=C3

DOS

IR

Vibrations