Geometry & MOs

Info

ID:	211066
PubChem CID:	80891936
Reduced:	OSN6C9H12 (1)
Stoich.:	ABC6D9E12 (1)
Weight, g/mol:	265.045588
ΔH_f, kcal/mol:	22.89
Dipole, Da:	4.93
IP(EA), eV:	-9.18(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(5-methylpyrimidin-2-yl)sulfanyl-2-methylsulfanylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCN1C(=O)NN=C1SC2=NC(=NC(=C2)N)C

DOS

IR

Vibrations