Geometry & MOs

Info

ID:	430635
PubChem CID:	135170701
Reduced:	SN2O2C6H10 (1)
Stoich.:	AB2C2D6E10 (1)
Weight, g/mol:	182.012554
ΔH_f, kcal/mol:	-37.92
Dipole, Da:	2.69
IP(EA), eV:	-9.23(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC(=NS1)OCCOC

DOS

IR

Vibrations