Geometry & MOs

Info

ID:	352511
PubChem CID:	127283599
Reduced:	O2N3C14H15 (1)
Stoich.:	A2B3C14D15 (1)
Weight, g/mol:	303.104148
ΔH_f, kcal/mol:	9.81
Dipole, Da:	4.95
IP(EA), eV:	-9.73(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NOC2=C1C=C(C=N2)C(=O)N3CCC(=C)CC3

DOS

IR

Vibrations