Geometry & MOs

Info

ID:	349722
PubChem CID:	127275874
Reduced:	O3N7C18H23 (1)
Stoich.:	A3B7C18D23 (1)
Weight, g/mol:	341.140927
ΔH_f, kcal/mol:	-22.87
Dipole, Da:	1.89
IP(EA), eV:	-9.32(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,1-dioxothiolan-3-yl)-[3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NO1)C2CCCN(C2)C(=O)CN3C=NC4=C(C3=O)C=NN4C

DOS

IR

Vibrations