Geometry & MOs

Info

ID:	351211
PubChem CID:	127279769
Reduced:	O2N5C18H27 (1)
Stoich.:	A2B5C18D27 (1)
Weight, g/mol:	293.173942
ΔH_f, kcal/mol:	-21.18
Dipole, Da:	4.91
IP(EA), eV:	-8.76(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-2-(oxolan-2-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=NN1C(C)CC(=O)N2CCCC(C2)CC3=NOC(=N3)C)C

DOS

IR

Vibrations