Geometry & MOs

Info

ID:	360670
PubChem CID:	127301315
Reduced:	O2N5C15H21 (1)
Stoich.:	A2B5C15D21 (1)
Weight, g/mol:	261.15896
ΔH_f, kcal/mol:	-47.37
Dipole, Da:	6.08
IP(EA), eV:	-9.48(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-5-[(4-imidazol-1-ylpiperidin-1-yl)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CN1C(=CC(=O)N(C1=O)C)CN2CCC(CC2)N3C=CN=C3

DOS

IR

Vibrations