Geometry & MOs

Info

ID:	189408
PubChem CID:	77850881
Reduced:	N3O4C17H31 (1)
Stoich.:	A3B4C17D31 (1)
Weight, g/mol:	363.179421
ΔH_f, kcal/mol:	-214.32
Dipole, Da:	4.32
IP(EA), eV:	-9.65(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-1-[4-hydroxy-4-(2-methoxyethyl)-3-methylpiperidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CCC(CC)CN1CC2(CCN(CC2)C(=O)C(CCO)N)OC1=O

DOS

IR

Vibrations