Geometry & MOs

Info

ID:	366003
PubChem CID:	127319308
Reduced:	ON4C12H14 (1)
Stoich.:	AB4C12D14 (1)
Weight, g/mol:	232.132411
ΔH_f, kcal/mol:	74.18
Dipole, Da:	3.52
IP(EA), eV:	-9.62(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(cyclopentylmethyl)-3-(pyrazol-1-ylmethyl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

C1CC(CC=C1)C2=NC(=NO2)CN3C=CC=N3

DOS

IR

Vibrations