Geometry & MOs

Info

ID:	430636
PubChem CID:	135170702
Reduced:	SN2F3C5H5 (1)
Stoich.:	AB2C3D5E5 (1)
Weight, g/mol:	196.028204
ΔH_f, kcal/mol:	-128.08
Dipole, Da:	4.39
IP(EA), eV:	-9.96(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-(3,3,3-trifluoropropyl)-1,2,4-thiadiazole

Drug info:

PubChemData

Smile

CC1=NC(=NS1)CC(F)(F)F

DOS

IR

Vibrations