Geometry & MOs

Info

ID:	371472
PubChem CID:	127346536
Reduced:	O2N4C15H22 (1)
Stoich.:	A2B4C15D22 (1)
Weight, g/mol:	336.216141
ΔH_f, kcal/mol:	-51.57
Dipole, Da:	4.32
IP(EA), eV:	-8.72(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperazin-1-yl]-2-(oxolan-3-yl)ethanone

Drug info:

PubChemData

Smile

C1CC(N(C1)C2=NN=CC=C2)CNC(=O)CC3CCOC3

DOS

IR

Vibrations