Geometry & MOs

Info

ID:	430631
PubChem CID:	135170697
Reduced:	ON2S2F3C6H7 (1)
Stoich.:	AB2C2D3E6F7 (1)
Weight, g/mol:	259.972346
ΔH_f, kcal/mol:	-170.05
Dipole, Da:	5.76
IP(EA), eV:	-8.98(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-[2-(trifluoromethylsulfanyl)ethylsulfanyl]-1,2,4-thiadiazole

Drug info:

PubChemData

Smile

CC1=NC(=NS1)SCCOC(F)(F)F

DOS

IR

Vibrations