Geometry & MOs

Info

ID:	85729
PubChem CID:	49878557
Reduced:	SN3O3C10H11 (1)
Stoich.:	AB3C3D10E11 (1)
Weight, g/mol:	363.169525
ΔH_f, kcal/mol:	-29.35
Dipole, Da:	3.15
IP(EA), eV:	-9.48(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzylpiperidin-4-yl)-3-pyridin-3-yl-1,2,4-oxadiazole-5-carboxamide

Drug info:

PubChemData

Smile

COC1=NOC(=C1)CCC(=O)NC2=NC=CS2

DOS

IR

Vibrations