Geometry & MOs

Info

ID:	365624
PubChem CID:	127318345
Reduced:	O2N6C15H16 (1)
Stoich.:	A2B6C15D16 (1)
Weight, g/mol:	326.96771
ΔH_f, kcal/mol:	35.71
Dipole, Da:	5.22
IP(EA), eV:	-9.05(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(4-bromothiophen-2-yl)-1,2,4-oxadiazol-5-yl]piperidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=NC2=C(C=NN12)C3=NOC(=N3)C4CCC(=O)NC4)C

DOS

IR

Vibrations