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28844433586
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42
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37549010053
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Agreement between experimental and nominal molecular weights indicates that the elution from the GPC columns is practically complete for 1-[N4]Bn and 1-[N6]Bn
-
Agreement between experimental and nominal molecular weights indicates that the elution from the GPC columns is practically complete for 1-[N4]Bn and 1-[N6]Bn.
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-
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43
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37549055543
-
-
One of the solvent polymorph structures for 1-[N4]H, with two molecules per asymmetric unit, is of lower quality, and it should be viewed as a supporting structure. A brief description of this structure is provided in the Supporting Information.
-
One of the solvent polymorph structures for 1-[N4]H, with two molecules per asymmetric unit, is of lower quality, and it should be viewed as a supporting structure. A brief description of this structure is provided in the Supporting Information.
-
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-
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44
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37549048380
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#1 (with symmetry operation #1: -x, -y, 1 -z) = -65.5(2)°.
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#1 (with symmetry operation #1: -x, -y, 1 -z) = -65.5(2)°.
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45
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33750690665
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37549072384
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Conformations for derivatives of calix[6]arenes in the solid state were described as winged cone, pinched cone, double partial cone, distorted 1,2,3-alternate, and 1,2,4,5-alternate: (a) Gutsche, C. D. Calixarenes Revisited; Royal Society of Chemistry: Cambridge, 1998; Ch. 4, pp 60-61.
-
Conformations for derivatives of calix[6]arenes in the solid state were described as winged cone, pinched cone, double partial cone, distorted 1,2,3-alternate, and 1,2,4,5-alternate: (a) Gutsche, C. D. Calixarenes Revisited; Royal Society of Chemistry: Cambridge, 1998; Ch. 4, pp 60-61.
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53
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0029927277
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(b) Janssen, R. G.; van Duynhoven, J. P. M.; Verboom, W.; van Hummel, G. J.; Harkema, S.; Reinhoudt, D. N. J. Am. Chem. Soc. 1996, 118, 3666-3675.
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Reinhoudt, D.N.6
-
54
-
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0001739862
-
-
Conformations for derivatives of calix[10]arenes in the solid state were described as pinched cone and pleated loop: Perrin, M.; Ehlinger, N.; Viola-Motta, L.; Lecocq, S.; Dumazet, I.; Bouoit-Montesino, S.; Lamartine, R. J. Inclusion Phenom. Macrocyclic Chem. 2001, 39, 273-276.
-
Conformations for derivatives of calix[10]arenes in the solid state were described as pinched cone and pleated loop: Perrin, M.; Ehlinger, N.; Viola-Motta, L.; Lecocq, S.; Dumazet, I.; Bouoit-Montesino, S.; Lamartine, R. J. Inclusion Phenom. Macrocyclic Chem. 2001, 39, 273-276.
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55
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37549064465
-
-
1/2)Δν). Free energy barriers are estimated using the Eyring equation, with the transmission coefficient set to one.
-
1/2)Δν). Free energy barriers are estimated using the Eyring equation, with the transmission coefficient set to one.
-
-
-
-
57
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37549002631
-
-
DNMR simulations were performed with a version of the computer program WINDNMR (Reich, H. J. J. Chem. Educ. Software 1996, 3, 2; http://www.chem.wisc.edu/areas/reich/plt/windnmr.htm).
-
DNMR simulations were performed with a version of the computer program WINDNMR (Reich, H. J. J. Chem. Educ. Software 1996, 3, 2; http://www.chem.wisc.edu/areas/reich/plt/windnmr.htm).
-
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58
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37549025196
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Royal Society of Chemistry: Cambridge, Ch. 4, p
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Gutsche, C. D. Calixarenes Revisited; Royal Society of Chemistry: Cambridge, 1998; Ch. 4, p 65.
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Gutsche, C.D.1
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37549046522
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4 point groups.
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4 point groups.
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60
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37549049490
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13C NMR spectrum for 1-[N8]Bn in chloroform-d shows no broadening at 298 K (Figure S11, Supporting Information). This might suggest that the n = 8 macrocycle might even be more conformationally mobile than the n = 6 macrocycle.
-
13C NMR spectrum for 1-[N8]Bn in chloroform-d shows no broadening at 298 K (Figure S11, Supporting Information). This might suggest that the n = 8 macrocycle might even be more conformationally mobile than the n = 6 macrocycle.
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