Geometry & MOs

Info

ID:	68423
PubChem CID:	46508379
Reduced:	ClON3C17H26 (1)
Stoich.:	ABC3D17E26 (1)
Weight, g/mol:	356.117235
ΔH_f, kcal/mol:	-54.26
Dipole, Da:	3.48
IP(EA), eV:	-8.5(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-fluorophenyl)methyl 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate

Drug info:

PubChemData

Smile

CCCCCCNC(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl

DOS

IR

Vibrations