Geometry & MOs

Info

ID:	344618
PubChem CID:	127268202
Reduced:	ON6C18H28 (1)
Stoich.:	AB6C18D28 (1)
Weight, g/mol:	286.154209
ΔH_f, kcal/mol:	20.57
Dipole, Da:	4.83
IP(EA), eV:	-8.78(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC1N2CCC(CC2)NC(=O)CN3CCN(CC3)C4=NN=CC=C4

DOS

IR

Vibrations