Geometry & MOs

Info

ID:	267026
PubChem CID:	103580485
Reduced:	FNSCl2O2H6C7 (1)
Stoich.:	ABCD2E2F6G7 (1)
Weight, g/mol:	253.086053
ΔH_f, kcal/mol:	-125.08
Dipole, Da:	4.34
IP(EA), eV:	-9.37(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-(6,6,6-trifluorohexan-2-yl)-1,3,4-thiadiazol-2-amine

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=CC(=C(C(=C1)Cl)F)Cl

DOS

IR

Vibrations