Geometry & MOs

Info

ID:	258084
PubChem CID:	103150769
Reduced:	F2N2O2C9H12 (1)
Stoich.:	A2B2C2D9E12 (1)
Weight, g/mol:	236.052797
ΔH_f, kcal/mol:	-156.37
Dipole, Da:	3.76
IP(EA), eV:	-10.32(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(chloromethyl)-2-[2-(2,2-difluoroethoxy)ethyl]pyrimidine

Drug info:

PubChemData

Smile

C1=C(C=NC(=N1)CCOCC(F)F)CO

DOS

IR

Vibrations