Geometry & MOs

Info

ID:	257505
PubChem CID:	103146703
Reduced:	ClON2F4C9H9 (1)
Stoich.:	ABC2D4E9F9 (1)
Weight, g/mol:	254.043375
ΔH_f, kcal/mol:	-223.43
Dipole, Da:	4.95
IP(EA), eV:	-10.49(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-[2-(2,2-difluoroethoxy)ethyl]-5-fluoro-6-methylpyrimidine

Drug info:

PubChemData

Smile

CC1=C(C(=NC(=N1)CCOCC(F)(F)F)Cl)F

DOS

IR

Vibrations