Geometry & MOs

Info

ID:	78573
PubChem CID:	49693654
Reduced:	SN2O2C11H14 (2)
Stoich.:	AB2C2D11E14 (2)
Weight, g/mol:	460.123898
ΔH_f, kcal/mol:	-75.87
Dipole, Da:	5.19
IP(EA), eV:	-9.19(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-ethylpiperidin-1-yl)sulfonyl-N-[5-(thiophen-2-ylmethyl)-1,3,4-oxadiazol-2-yl]benzamide

Drug info:

PubChemData

Smile

CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=NN=C(O2)CC3=CC=CS3

DOS

IR

Vibrations