Geometry & MOs

Info

ID:	287820
PubChem CID:	104295595
Reduced:	SF2N2H14C15 (1)
Stoich.:	AB2C2D14E15 (1)
Weight, g/mol:	239.087018
ΔH_f, kcal/mol:	-43.57
Dipole, Da:	7.24
IP(EA), eV:	-8.56(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(2,4-difluoro-5-methylphenyl)-1,3,4-oxadiazol-2-yl]ethanamine

Drug info:

PubChemData

Smile

CCCC1=C(SC(=C1N)C#N)C2=C(C=C(C(=C2)C)F)F

DOS

IR

Vibrations