Geometry & MOs

Info

ID:	7098
PubChem CID:	71207
Reduced:	SH4N4C5 (1)
Stoich.:	AB4C4D5 (1)
Weight, g/mol:	152.015667
ΔH_f, kcal/mol:	84.1
Dipole, Da:	1.6
IP(EA), eV:	-9.48(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-pyrazolo[3,4-d]pyrimidine-4-thiol

Drug info:

PubChemData

Smile

C1=NNC2=C1C(=NC=N2)S

DOS

IR

Vibrations