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1542535771
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note
-
To check for methodology correctness the same conformational search was also carried out on 5CITEP (7). The global minimum found showed an atomic roots means square distance on all heavy atoms of only 0.36.
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23
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24
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1542430965
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note
-
The complex IN/5CITEP was also submitted to the same minimization procedure for direct comparisons.
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26
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1542430966
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note
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4 (297.31): C, 68.68; H, 5.09; 4.71. Found: 68.63; 5.18; 4.74. Data for compounds 8b-f and 11a-f are reported in the Supplementary Information section.
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