Geometry & MOs

Info

ID:	149616
PubChem CID:	53789290
Reduced:	NF3O3Cl4H18C21 (1)
Stoich.:	AB3C3D4E18F21 (1)
Weight, g/mol:	158.02469
ΔH_f, kcal/mol:	-210.96
Dipole, Da:	5.87
IP(EA), eV:	-9.27(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-1,5-dimethylpyrimidin-2-one

Drug info:

PubChemData

Smile

CCON=C(C1=CC=C(C=C1)CCOC2=C(C=C(C=C2Cl)OCC=C(Cl)Cl)Cl)C(F)(F)F

DOS

IR

Vibrations