Geometry & MOs

Info

ID:	38652
PubChem CID:	8137341
Reduced:	NSF2O5C16H17 (1)
Stoich.:	ABC2D5E16F17 (1)
Weight, g/mol:	344.097249
ΔH_f, kcal/mol:	-255.54
Dipole, Da:	7.59
IP(EA), eV:	-10.25(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl] 3,4-difluorobenzoate

Drug info:

PubChemData

Smile

C1CS(=O)(=O)C[C@H]1N(C2CC2)C(=O)COC(=O)C3=CC(=C(C=C3)F)F

DOS

IR

Vibrations