Synthesis of Triazolodiazepinium Salts: Sequential [3<sup>+</sup>+2] Cycloaddition/Rearrangement Reaction of 1-Aza-2-azoniaallenium Cation Intermediates Generated from Piperidin-4-ones.
Luan, Lin-Bo; Song, Zi-Jie; Li, Zhi-Ming; Wang, Quan-Rui; Wang, Jing-Mei; The Journal of organic chemistry 83 (2018) 3441–3452; doi:10.1021/acs.joc.7b02742

data_4033555
_publ_section_title
;
 Synthesis of Triazolodiazepinium Salts: Sequential [3<sup>+</sup>+2]
 Cycloaddition/Rearrangement Reaction of 1-Aza-2-azoniaallenium Cation
 Intermediates Generated from Piperidin-4-ones.
;
_journal_issue                   7
_journal_name_full               'The Journal of organic chemistry'
_journal_page_first              3441
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_journal_paper_doi               10.1021/acs.joc.7b02742
_journal_volume                  83
_journal_year                    2018
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; 
 w=1/[\s^2^(Fo^2^)+(0.2000P)^2^] 
 where P=(Fo^2^+2Fc^2^)/3 
;
_refine_ls_weighting_scheme      calc
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_cod_data_source_file            jo7b02742_si_002.cif
_cod_data_source_block           mo_41017a
_cod_depositor_comments
;
       Adding full bibliography for 4033555.cif.

2020-09-21
Z value and formula fixed to values more according to usual
chemical conventions.                 miguel
;
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_cod_original_cell_volume        1346.0(7)
_cod_original_formula_sum        'C13 H12 Br0.50 N3.50 O4.50'
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