Geometry & MOs

Info

ID:	31493
PubChem CID:	855786
Reduced:	FOS2N4H11C14 (1)
Stoich.:	ABC2D4E11F14 (1)
Weight, g/mol:	300.073262
ΔH_f, kcal/mol:	17.92
Dipole, Da:	5.59
IP(EA), eV:	-9.03(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-fluorophenyl)methylsulfanyl]-5-(3-methylphenyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

C1=CSC(=C1)C2=NN=C(N2C3=CC=C(C=C3)F)SCC(=O)N

DOS

IR

Vibrations