Geometry & MOs

Info

ID:	194933
PubChem CID:	78610709
Reduced:	NSO6C21H25 (1)
Stoich.:	ABC6D21E25 (1)
Weight, g/mol:	421.119523
ΔH_f, kcal/mol:	-218.29
Dipole, Da:	8.47
IP(EA), eV:	-9.16(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[4-(methanesulfonamido)phenyl]-1-oxopropan-2-yl] 2-(4-ethoxyphenoxy)acetate

Drug info:

PubChemData

Smile

CC(C)COC1=CC=C(C=C1)C(=O)OC(C)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C

DOS

IR

Vibrations