Geometry & MOs

Info

ID:	365759
PubChem CID:	127318484
Reduced:	O2N4C15H22 (1)
Stoich.:	A2B4C15D22 (1)
Weight, g/mol:	334.200491
ΔH_f, kcal/mol:	-45.73
Dipole, Da:	6.75
IP(EA), eV:	-9.75(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[1-(3-ethyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]-(7-oxabicyclo[2.2.1]heptan-2-yl)methanone

Drug info:

PubChemData

Smile

CC(C)C1=NN=C2N1CCN(C2)C(=O)C3CC4CCC3O4

DOS

IR

Vibrations