Geometry & MOs

Info

ID:	289723
PubChem CID:	104370008
Reduced:	ClFO2N4H8C9 (1)
Stoich.:	ABC2D4E8F9 (1)
Weight, g/mol:	298.027583
ΔH_f, kcal/mol:	-75.4
Dipole, Da:	3.71
IP(EA), eV:	-9.56(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-(4-chlorophenyl)-5-propan-2-yl-1H-pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CN1C=CC(=N1)CN2C(=O)C(=C(NC2=O)Cl)F

DOS

IR

Vibrations