Geometry & MOs

Info

ID:	441933
PubChem CID:	135246799
Reduced:	OF2N3H19C20 (1)
Stoich.:	AB2C3D19E20 (1)
Weight, g/mol:	338.03784
ΔH_f, kcal/mol:	-68.2
Dipole, Da:	4.98
IP(EA), eV:	-9.36(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-bromopyridin-2-yl)oxy-N-(2-methoxyethyl)-N-methylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=N1)C)C2=C(N=CC=C2)OC3=CN=C(C=C3)C(C)(F)F

DOS

IR

Vibrations