Geometry & MOs

Info

ID:	20085
PubChem CID:	578971
Reduced:	FSO2N3H14C16 (1)
Stoich.:	ABC2D3E14F16 (1)
Weight, g/mol:	331.079076
ΔH_f, kcal/mol:	-17.82
Dipole, Da:	6.11
IP(EA), eV:	-8.71(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-fluoroanilino)methyl]-5-(2-methoxyphenyl)-1,3,4-oxadiazole-2-thione

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2=NN(C(=S)O2)CNC3=CC=CC=C3F

DOS

IR

Vibrations