Geometry & MOs

Info

ID:	339013
PubChem CID:	127260024
Reduced:	SN2O4C14H14 (1)
Stoich.:	AB2C4D14E14 (1)
Weight, g/mol:	364.09806
ΔH_f, kcal/mol:	-76.81
Dipole, Da:	5.97
IP(EA), eV:	-9.16(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(benzenesulfonyloxy)ethoxy]ethyl 4-methylbenzoate

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)S(=O)(=O)O)N/N=C/C2=CC=CC=C2

DOS

IR

Vibrations