Geometry & MOs

Info

ID:	262902
PubChem CID:	103328654
Reduced:	OSN4C12H16 (1)
Stoich.:	ABC4D12E16 (1)
Weight, g/mol:	294.151433
ΔH_f, kcal/mol:	-7.9
Dipole, Da:	5.71
IP(EA), eV:	-8.3(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-2,4-dimethylpentan-2-ol

Drug info:

PubChemData

Smile

C1CC(C(C1)O)CNC2=C3C=CSC3=NC(=N2)N

DOS

IR

Vibrations