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34948857484
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The initial model was constructed on the basis of the crystal structure of [Co(tacn)2][α-PW12O40]·6DMSO 1·DMSO; see ref 21 and the Supporting Information, which was characterized by single-crystal X-ray analysis. The atomic coordinates of PW and Co-tacn were fixed
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40]·6DMSO (1·DMSO; see ref 21 and the Supporting Information), which was characterized by single-crystal X-ray analysis. The atomic coordinates of PW and Co-tacn were fixed.
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47
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34948886200
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2O interact with the NH moieties of tacn as DMSO in 1·DMSO (see the Supporting Information).
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2O interact with the NH moieties of tacn as DMSO in 1·DMSO (see the Supporting Information).
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-
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50
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34948829651
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-1, respectively.
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-1, respectively.
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-
-
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53
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34948881244
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-1), respectively.
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-1), respectively.
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55
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34948890044
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TON, amount of epoxide, amount of surface POM, The amount of surface POM for 10 μmol of 4·H2O was calculated by the following formula: amount of POM (mol, S × 0.785 × 0.5, A × 10 -18 × NA, 10 × 10-6M, where S, A, NA, and M are the BET surface area calculated from N2 adsorption for 4·H2O (m2 g_1, cross-section area of SiVWH (ca. 0.8 nm2, Avogadro's number (6.02 × 1023, and formula molar mass of 4·H2O (3298 g mol-1, respectively. The numbers in the first term show the filling factor of the close packing (ca. 0.785) and ratio of SiVWH occupying the surface of 4·H2O according to the crystal structure ca. 0.5
-
2O according to the crystal structure (ca. 0.5).
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