Table 1.

The HOMO and LUMO energy, energy gap (eV), chemical potential (μ), chemical hardness (η), electronegativity (ξ), and electrophilicity (ω), (in eV) of Trenbolone Acetate.

EHOMO	The energy of the Highest Occupied Molecular Orbital	− 0.22365 eV
ELUMO	The energy of the Lowest Unoccupied Molecular Orbital	−0.08409 eV
Egap = ELUMO − EHOMO	Energy gap	+ 0.13965 eV
µ = (ELUMO + EHOMO)/2	Chemical potential	−0.15387 eV
ɳ = (ELUMO − EHOMO)/2	Chemical hardness	+ 0.069825 eV
χ = -(ELUMO + EHOMO)/2	Electronegativity	+ 0.15387 eV
$\omega =\frac{{\mathrm{\chi }}^2}{2\eta }$	Electrophilicity index	+ 0.1696 eV