Geometry & MOs

Info

ID:	56480
PubChem CID:	17435854
Reduced:	Cl2N2O3H12C16 (1)
Stoich.:	A2B2C3D12E16 (1)
Weight, g/mol:	357.094726
ΔH_f, kcal/mol:	-24.88
Dipole, Da:	4.05
IP(EA), eV:	-9.16(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-fluorophenyl)-2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NN=C(O2)COC3=C(C(=CC=C3)Cl)Cl

DOS

IR

Vibrations