Geometry & MOs

Info

ID:	199783
PubChem CID:	79294975
Reduced:	ClON3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	292.054945
ΔH_f, kcal/mol:	-5.5
Dipole, Da:	3.62
IP(EA), eV:	-9.22(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(2-chlorophenyl)methyl]-1,3-dimethyl-4H-imidazo[4,5-c]pyrazole-5-thione

Drug info:

PubChemData

Smile

CCCC(COC)N1C(=NC2=C1N=CC=C2)CCl

DOS

IR

Vibrations