Geometry & MOs

Info

ID:	262564
PubChem CID:	103301361
Reduced:	OF3H11C12 (1)
Stoich.:	AB3C11D12 (1)
Weight, g/mol:	244.1075
ΔH_f, kcal/mol:	-151.88
Dipole, Da:	2.74
IP(EA), eV:	-10.38(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4,5-trifluorophenyl)heptan-1-one

Drug info:

PubChemData

Smile

C1CC(C1)CC(=O)C2=CC(=C(C=C2F)F)F

DOS

IR

Vibrations