Geometry & MOs

Info

ID:	178096
PubChem CID:	76276733
Reduced:	SN3O4C21H23 (1)
Stoich.:	AB3C4D21E23 (1)
Weight, g/mol:	461.125671
ΔH_f, kcal/mol:	-124.38
Dipole, Da:	6.2
IP(EA), eV:	-8.71(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-[(4-methoxyphenyl)sulfonylamino]propanoate

Drug info:

PubChemData

Smile

CC(=O)NC(CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC)C3=CC=CS3

DOS

IR

Vibrations