. Author manuscript; available in PMC: 2018 Nov 13.

Published in final edited form as: Chemistry. 2007;13(30):8411–8427. doi: 10.1002/chem.200601691

Table 3.

Calculated orientation factors κ², Förster distances R₀, and theoretical EET for compounds 17β-Zn,3β, 17β-Zn,3α, and 17α-Zn,3β.

Compound	κ²	R₀ [Å]	Φ_EET,calcd	Φ_EET,exp	Δ [%]^[a]	τ₁ [ps]
17β-Zn,3β	1.0	23.4	0.22	0.21	+4	1190
17β-Zn,3α	0.52	21.0	0.31	0.31	0	910
17α-Zn,3β	0.94	23.1	0.40	0.37	+7	990

^[a]

Percent difference between Φ_EET,calcd and Φ_EET,exp relative to Φ_EET,exp.