Geometry & MOs

Info

ID:	260843
PubChem CID:	103206755
Reduced:	BrF3O3H8C9 (1)
Stoich.:	AB3C3D8E9 (1)
Weight, g/mol:	285.94524
ΔH_f, kcal/mol:	-236.94
Dipole, Da:	5.86
IP(EA), eV:	-10.03(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethanone

Drug info:

PubChemData

Smile

C1=C(OC(=C1)Br)C(=O)CCOCC(F)(F)F

DOS

IR

Vibrations