Geometry & MOs

Info

ID:	419187
PubChem CID:	135107688
Reduced:	ClFN4C20H24 (1)
Stoich.:	ABC4D20E24 (1)
Weight, g/mol:	269.092417
ΔH_f, kcal/mol:	-1.92
Dipole, Da:	1.52
IP(EA), eV:	-8.55(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-4-methoxy-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CN(C)C1=NC=C2CCC3(C2=N1)CCCN(C3)CC4=C(C=C(C=C4)Cl)F

DOS

IR

Vibrations