Geometry & MOs

Info

ID:	257513
PubChem CID:	103146736
Reduced:	ClIOF2N2C11H12 (1)
Stoich.:	ABCD2E2F11G12 (1)
Weight, g/mol:	403.99639
ΔH_f, kcal/mol:	-82.53
Dipole, Da:	4.23
IP(EA), eV:	-9.98(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-[2-(2,2-difluoroethoxy)ethyl]-5-iodo-6-(2-methylpropyl)pyrimidine

Drug info:

PubChemData

Smile

C1CC1C2=C(C(=NC(=N2)CCOCC(F)F)Cl)I

DOS

IR

Vibrations