Geometry & MOs

Info

ID:	365672
PubChem CID:	127318393
Reduced:	N3O3C11H13 (1)
Stoich.:	A3B3C11D13 (1)
Weight, g/mol:	377.140927
ΔH_f, kcal/mol:	-4.02
Dipole, Da:	3.25
IP(EA), eV:	-9.84(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-(benzenesulfonyl)piperidin-3-yl]-3-(oxan-4-yl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C2=NC(=NO2)C3CCOCC3

DOS

IR

Vibrations