Geometry & MOs

Info

ID:	307934
PubChem CID:	125310794
Reduced:	ON2C4H5 (2)
Stoich.:	AB2C4D5 (2)
Weight, g/mol:	194.080376
ΔH_f, kcal/mol:	20.73
Dipole, Da:	4.6
IP(EA), eV:	-9.34(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-[(5S)-5-(aminomethyl)-2,5-dihydro-1,2,4-oxadiazol-3-yl]-3H-pyridin-2-one

Drug info:

PubChemData

Smile

C1=C[C@@H](C(=O)N=C1)C2=N[C@@H](ON2)CN

DOS

IR

Vibrations