Geometry & MOs

Info

ID:	289731
PubChem CID:	104370647
Reduced:	ClN2F3O3H6C11 (1)
Stoich.:	AB2C3D3E6F11 (1)
Weight, g/mol:	273.971211
ΔH_f, kcal/mol:	-252.32
Dipole, Da:	4.3
IP(EA), eV:	-9.87(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-(3-chloro-2-fluorophenyl)-1H-pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)OC(F)(F)F)N2C(=O)C=C(NC2=O)Cl

DOS

IR

Vibrations