Geometry & MOs

Info

ID:	38792
PubChem CID:	8137932
Reduced:	Cl2N3O3H13C17 (1)
Stoich.:	A2B3C3D13E17 (1)
Weight, g/mol:	413.175084
ΔH_f, kcal/mol:	-49.28
Dipole, Da:	6.48
IP(EA), eV:	-9.54(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenoxy)-N-[5-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pentyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC2=CC=CC=C12)CN3C(=O)C(=C(C=N3)Cl)Cl)C(=O)OC

DOS

IR

Vibrations