Geometry & MOs

Info

ID:	344620
PubChem CID:	127268204
Reduced:	ON6C13H18 (1)
Stoich.:	AB6C13D18 (1)
Weight, g/mol:	300.169859
ΔH_f, kcal/mol:	56.97
Dipole, Da:	7.75
IP(EA), eV:	-8.86(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-5-[1-(4-pyridazin-3-ylpiperazin-1-yl)ethyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=NN=C(O1)C(C)N2CCN(CC2)C3=NN=CC=C3

DOS

IR

Vibrations