Geometry & MOs

Info

ID:	236403
PubChem CID:	92712750
Reduced:	ClFN2O5H16C22 (1)
Stoich.:	ABC2D5E16F22 (1)
Weight, g/mol:	392.069448
ΔH_f, kcal/mol:	-146.42
Dipole, Da:	3.05
IP(EA), eV:	-9.05(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)N1[C@@H](OC(=N1)C2=C(C=CC(=C2)Cl)OC(=O)C)C3=CC=C(O3)C4=CC=C(C=C4)F

DOS

IR

Vibrations