Geometry & MOs

Info

ID:	205183
PubChem CID:	80065963
Reduced:	F2N3O3C12H13 (1)
Stoich.:	A2B3C3D12E13 (1)
Weight, g/mol:	384.04471
ΔH_f, kcal/mol:	-143.56
Dipole, Da:	1.69
IP(EA), eV:	-9.33(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-5-iodo-2-[(6-methoxypyridin-3-yl)methyl]-6-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

COC1=NC=C(C=C1)CC2=NOC(=N2)CC(C(F)F)O

DOS

IR

Vibrations