Tribenzotriquinacene-Based Crown Ethers: Synthesis and Selective Complexation with Ammonium Salts.
Zhang, Yu-Fei; Cao, Xiao-Ping; Chow, Hak-Fun; Kuck, Dietmar; The Journal of organic chemistry 82 (2017) 179–187; doi:10.1021/acs.joc.6b02326

data_4032246
_publ_section_title
;
 Tribenzotriquinacene-Based Crown Ethers: Synthesis and Selective
 Complexation with Ammonium Salts.
;
_journal_issue                   1
_journal_name_full               'The Journal of organic chemistry'
_journal_page_first              179
_journal_page_last               187
_journal_paper_doi               10.1021/acs.joc.6b02326
_journal_volume                  82
_journal_year                    2017
_chemical_formula_moiety         'C25 H22 O2'
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CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
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CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
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CrysAlisPro, Agilent Technologies,
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  4 omega  -82.00  -38.50   1.5000    1.5000
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  5 omega -104.00  -77.00   1.5000    1.5000
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  6 omega   29.00   56.00   1.5000    1.5000
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  7 omega   77.00  128.00   1.5000    1.5000
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  8 omega   25.00   73.00   1.5000    1.5000
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  9 omega   41.00  120.50   1.5000    1.5000
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 10 omega   35.00   84.50   1.5000    1.5000
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 11 omega  -14.00   86.50   1.5000    1.5000
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 12 omega   95.00  135.50   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 13 omega   56.00   86.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 14 omega   39.00   72.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 15 omega  137.00  170.00   1.5000    1.5000
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 16 omega   86.00  111.50   1.5000    1.5000
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 17 omega   38.00   71.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 18 omega  116.00  177.50   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 19 omega   52.00   91.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 20 omega  104.00  131.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 21 omega   50.00   80.00   1.5000    1.5000
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 22 omega  121.00  160.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 23 omega   65.00   92.00   1.5000    1.5000
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 24 omega  103.00  139.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 25 omega   81.00  132.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 26 omega   57.00  108.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 27 omega   52.00   77.50   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 28 omega   59.00   86.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 29 omega   85.00  133.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 30 omega   42.00   97.50   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 31 omega  100.00  136.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
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 32 omega   39.00   96.00   1.5000    1.5000
omega____ theta____ kappa____ phi______ frames
    -      112.0000 -111.0000   90.0000 38
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CrysAlisPro, Agilent Technologies,
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Empirical absorption correction using spherical harmonics,
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1. Fixed Uiso
 At 1.2 times of:
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 At 1.5 times of:
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2.a Ternary CH refined with riding coordinates:
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2.b Aromatic/amide H refined with riding coordinates:
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2.c Idealised Me refined as rotating group:
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