Geometry & MOs

Info

ID:	284972
PubChem CID:	104086390
Reduced:	ClNOSC9H12 (1)
Stoich.:	ABCDE9F12 (1)
Weight, g/mol:	207.989568
ΔH_f, kcal/mol:	-26.99
Dipole, Da:	2.35
IP(EA), eV:	-8.56(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-chloropropan-2-ylsulfanyl)-3-methyl-1,2,4-thiadiazole

Drug info:

PubChemData

Smile

CC(CCl)SC1=C(C=CC=N1)OC

DOS

IR

Vibrations