Geometry & MOs

Info

ID:	230360
PubChem CID:	87570717
Reduced:	FNOC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	401.05997
ΔH_f, kcal/mol:	-67.48
Dipole, Da:	2.39
IP(EA), eV:	-8.93(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(6-bromo-5-methylpyridin-3-yl)-4-morpholin-4-ylpteridin-2-amine

Drug info:

PubChemData

Smile

CCCC/C=C/COC1=CC=CC(=C1F)CN

DOS

IR

Vibrations