Geometry & MOs

Info

ID:	346312
PubChem CID:	127270816
Reduced:	SO2N5C19H19 (1)
Stoich.:	AB2C5D19E19 (1)
Weight, g/mol:	342.169191
ΔH_f, kcal/mol:	70.56
Dipole, Da:	6.46
IP(EA), eV:	-9.42(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(oxolan-2-yl)-1-[4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CC1C2=NC(=CS2)C(=O)N3CCC(CC3)C4=NC(=NO4)C5=CC=CC=N5

DOS

IR

Vibrations