Geometry & MOs

Info

ID:	260492
PubChem CID:	103193742
Reduced:	BrN2O2F3H10C11 (1)
Stoich.:	AB2C2D3E10F11 (1)
Weight, g/mol:	365.9463
ΔH_f, kcal/mol:	-219.07
Dipole, Da:	5.25
IP(EA), eV:	-9.05(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-bromo-2-(trifluoromethoxy)phenyl]-6-hydroxypyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1CNC(=O)N(C1)C2=C(C=C(C=C2)Br)OC(F)(F)F

DOS

IR

Vibrations