Geometry & MOs

Info

ID:	158763
PubChem CID:	56468352
Reduced:	OF4N7H13C18 (1)
Stoich.:	AB4C7D13E18 (1)
Weight, g/mol:	427.095979
ΔH_f, kcal/mol:	-85.51
Dipole, Da:	6.75
IP(EA), eV:	-9.68(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[4-fluoro-3-(5-methyltetrazol-1-yl)phenyl]propanamide

Drug info:

PubChemData

Smile

CC1=NN=NN1C2=C(C=CC(=C2)NC(=O)CN3C4=CC=CC=C4N=C3C(F)(F)F)F

DOS

IR

Vibrations