Geometry & MOs

Info

ID:	202735
PubChem CID:	79717770
Reduced:	BrN3C13H14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	343.99342
ΔH_f, kcal/mol:	55.06
Dipole, Da:	1.32
IP(EA), eV:	-9.16(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-fluoropyridin-2-yl)-5-iodo-N,6-dimethylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1NCCC2=CC=NC=C2)Br

DOS

IR

Vibrations