Geometry & MOs

Info

ID:	78593
PubChem CID:	49693742
Reduced:	ClS2N4O4H17C21 (1)
Stoich.:	AB2C4D4E17F21 (1)
Weight, g/mol:	451.09687
ΔH_f, kcal/mol:	-17.68
Dipole, Da:	2.28
IP(EA), eV:	-9.04(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[(5-chlorothiophen-2-yl)methyl]-1,3,4-oxadiazol-2-yl]-3,4,5-triethoxybenzamide

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NN=C(O3)CC4=CC=C(S4)Cl

DOS

IR

Vibrations