Geometry & MOs

Info

ID:	365989
PubChem CID:	127319279
Reduced:	ON3C8H11 (2)
Stoich.:	AB3C8D11 (2)
Weight, g/mol:	292.153541
ΔH_f, kcal/mol:	14.77
Dipole, Da:	3.22
IP(EA), eV:	-9.52(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-(oxan-2-ylmethoxy)ethyl]-3-(pyrazol-1-ylmethyl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)N2CCC(CC2)C3=NC(=NO3)CN4C=CC=N4

DOS

IR

Vibrations