Geometry & MOs

Info

ID:	344637
PubChem CID:	127268222
Reduced:	O2N6C15H20 (1)
Stoich.:	A2B6C15D20 (1)
Weight, g/mol:	274.154209
ΔH_f, kcal/mol:	-19.37
Dipole, Da:	1.91
IP(EA), eV:	-9.0(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C(=CC(=O)N(C1=O)C)CN2CCN(CC2)C3=NN=CC=C3

DOS

IR

Vibrations