Geometry & MOs

Info

ID:	7010
PubChem CID:	70976
Reduced:	SN5C6H7 (1)
Stoich.:	AB5C6D7 (1)
Weight, g/mol:	181.042216
ΔH_f, kcal/mol:	73.7
Dipole, Da:	4.97
IP(EA), eV:	-8.72(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methylsulfanyl-7H-purin-2-amine

Drug info:

PubChemData

Smile

CSC1=NC(=NC2=C1NC=N2)N

DOS

IR

Vibrations