Geometry & MOs

Info

ID:	14214
PubChem CID:	406689
Reduced:	SN5C7H9 (1)
Stoich.:	AB5C7D9 (1)
Weight, g/mol:	195.057866
ΔH_f, kcal/mol:	66.79
Dipole, Da:	4.2
IP(EA), eV:	-8.7(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCSC1=NC(=C2C=NNC2=N1)N

DOS

IR

Vibrations