Geometry & MOs

Info

ID:	21905
PubChem CID:	593491
Reduced:	SN4C5H8 (1)
Stoich.:	AB4C5D8 (1)
Weight, g/mol:	156.046967
ΔH_f, kcal/mol:	33.43
Dipole, Da:	3.07
IP(EA), eV:	-8.77(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-diamino-2-methylpyrimidine-4-thiol

Drug info:

PubChemData

Smile

CC1=NC(=C(C(=N1)S)N)N

DOS

IR

Vibrations