Geometry & MOs

Info

ID:	210933
PubChem CID:	80873685
Reduced:	O2N4C13H16 (1)
Stoich.:	A2B4C13D16 (1)
Weight, g/mol:	289.15904
ΔH_f, kcal/mol:	-17.87
Dipole, Da:	2.46
IP(EA), eV:	-9.49(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-4-(2-propan-2-ylphenoxy)-N-propylpyrimidin-2-amine

Drug info:

PubChemData

Smile

COC1=NC(=NC(=N1)N)OCCCC2=CC=CC=C2

DOS

IR

Vibrations