Geometry & MOs

Info

ID:	236370
PubChem CID:	92712544
Reduced:	N2O2C9H9 (2)
Stoich.:	A2B2C9D9 (2)
Weight, g/mol:	326.126657
ΔH_f, kcal/mol:	-3.83
Dipole, Da:	4.58
IP(EA), eV:	-8.79(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2S)-5-[(2-methoxyphenoxy)methyl]-2-phenyl-2H-1,3,4-oxadiazol-3-yl]ethanone

Drug info:

PubChemData

Smile

CC(=O)N1[C@H](OC(=N1)C2=CC=CC=C2)C3=CC(=C(C=C3)N(C)C)[N+](=O)[O-]

DOS

IR

Vibrations