Geometry & MOs

Info

ID:	210967
PubChem CID:	80877270
Reduced:	FO2N4C12H13 (1)
Stoich.:	AB2C4D12E13 (1)
Weight, g/mol:	233.09644
ΔH_f, kcal/mol:	-50.18
Dipole, Da:	3.89
IP(EA), eV:	-9.51(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-fluoro-5-methylphenoxy)-5-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)OC2=NC(=NC(=N2)OC)NC

DOS

IR

Vibrations