Geometry & MOs

Info

ID:	144784
PubChem CID:	53412859
Reduced:	FN2H5C7 (1)
Stoich.:	AB2C5D7 (1)
Weight, g/mol:	242.93808
ΔH_f, kcal/mol:	4.54
Dipole, Da:	5.51
IP(EA), eV:	-9.13(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-(5-bromo-1H-imidazol-3-ium-3-yl)-2,2,2-trifluoroethanone

Drug info:

PubChemData

Smile

C1=CNC2=C1C(=NC=C2)F

DOS

IR

Vibrations