Geometry & MOs

Info

ID:	253652
PubChem CID:	103119789
Reduced:	SN5C6H7 (1)
Stoich.:	AB5C6D7 (1)
Weight, g/mol:	218.037465
ΔH_f, kcal/mol:	109.92
Dipole, Da:	9.77
IP(EA), eV:	-8.59(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-pyrazolo[1,5-a]pyrazin-3-yl-1,2-dihydro-1,2,4-triazole-3-thione

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C2=NC(=S)NN2

DOS

IR

Vibrations