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note
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-3 R = 0.0293 and Rw = 0.0798. CCDC-179394 contains the supplementary crystallographic data for this paper. These data can be obtained free of charge at www.ccdc.cam.ac.uk/conts/retrieving.html [or from the Cambridge Crystallographic Data Centre, 12, Union Road, Cambridge CB2 1EZ, UK; fax: (internat.) +44-1223/ 336-033; E-mail: deposit@ccdc.cam.ac.uk].
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39
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0042595887
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note
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40
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note
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Selected and all crystallographic data are summarized in supporting information (hydrogens are omitted for clarity).
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The basis sets denote as 631SDD and 321LAN consists of Stuttgart and LANL2DZ effective core potentials for Pd atoms and 6-31G and 3-21G basis sets for the rest, respectively.
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