Geometry & MOs

Info

ID:	159498
PubChem CID:	57288256
Reduced:	SO2Cl4N6H14C18 (1)
Stoich.:	AB2C4D6E14F18 (1)
Weight, g/mol:	152.015667
ΔH_f, kcal/mol:	-14.53
Dipole, Da:	12.31
IP(EA), eV:	-8.59(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-pyrazol-1-yl-1,2,5-thiadiazole

Drug info:

PubChemData

Smile

CC(=O)NC1=CC(=C(C=C1)Cl)NC2=C(C(=O)N(N2)C3=C(C=C(C=C3Cl)Cl)Cl)SC(=N)N

DOS

IR

Vibrations