Geometry & MOs

Info

ID:	65994
PubChem CID:	46484907
Reduced:	O4N5H21C24 (1)
Stoich.:	A4B5C21D24 (1)
Weight, g/mol:	441.147075
ΔH_f, kcal/mol:	-18.29
Dipole, Da:	5.01
IP(EA), eV:	-8.33(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-piperidin-1-ylsulfonylphenyl)-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propanamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CCC3=NC(=NO3)C4=CN=CC=C4

DOS

IR

Vibrations