Table 1.

Total Stereoisomeric Speciation with ee Values Predicted Using SO-CovSel and a de Value from Absorbance Data^a

RR			SS
calcd	actual	abs error	calcd	actual	abs error
0.73	0	0.7	97.0	100	−2.9
4.64	0	4.6	4.37	0	4.4
91.1	95	−3.9	−1.26	0	−1.3
−4.07	0	−4.1	−7.90	0	−7.9
4.22	5.26	−1.0	8.10	5.26	2.8
13.0	10	3.0	68.0	65	3.0
38.5	35	3.5	3.47	5	−1.5
58.2	60	−1.8	5.43	0	5.4
31.2	20	11.3	30.6	20	10.6
0.06	0	0.1	67.8	65	2.8
RS			SR
calcd	actual	abs error	calcd	actual	abs error
−3.90	0	−3.9	6.08	0	6.1
−2.78	0	−2.8	93.8	100	−6.2
8.16	5	3.2	2.02	0	2.0
102	95	6.7	10.3	5	5.3
20.2	21.05	−0.9	67.5	68.42	−0.9
11.6	15	−3.4	7.42	10	−2.6
62.1	60	2.1	−4.13	0	−4.1
−1.11	0	−1.1	37.5	40	−2.5
−9.19	0	−9.2	47.3	60	−12.7
15.9	15	0.9	16.34	20	−3.7

^aAll values are given in percentages.