Geometry & MOs

Info

ID:	210672
PubChem CID:	80838916
Reduced:	N3C7H14 (2)
Stoich.:	A3B7C14 (2)
Weight, g/mol:	268.172168
ΔH_f, kcal/mol:	-3.0
Dipole, Da:	0.98
IP(EA), eV:	-8.94(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(3-ethylpentan-2-yl)-6-N-methyl-2-methylsulfanylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCC(CC)C(C)NC1=NC(=NC(=N1)N)N(CC)CC

DOS

IR

Vibrations