Geometry & MOs

Info

ID:	24454
PubChem CID:	610371
Reduced:	ClFN2H6C10 (1)
Stoich.:	ABC2D6E10 (1)
Weight, g/mol:	208.020354
ΔH_f, kcal/mol:	14.72
Dipole, Da:	2.07
IP(EA), eV:	-10.06(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-6-(3-fluorophenyl)pyrimidine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)C2=CC(=NC=N2)Cl

DOS

IR

Vibrations