Geometry & MOs

Info

ID:	352532
PubChem CID:	127283620
Reduced:	NOC17H25 (1)
Stoich.:	ABC17D25 (1)
Weight, g/mol:	303.104148
ΔH_f, kcal/mol:	-66.91
Dipole, Da:	3.47
IP(EA), eV:	-9.22(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylidenepiperidin-1-yl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one

Drug info:

PubChemData

Smile

C=C1CCN(CC1)C(=O)C23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations