Divergent [3+2] annulations of oxime acetates with thioaurones/aurones leading to benzothiazino-/benzoyl-pyrroles
Reddy, Chada Raji; Enagandhula, Damodar; Ramaraju, Andhavaram; Shivakrishna, Avula; Adepu, Raju; Chemical Communications 61 (2025) 10162–10165; doi:10.1039/D5CC00956A

data_7134643
_publ_section_title
;
 Divergent [3+2] annulations of oxime acetates with thioaurones/aurones
 leading to benzothiazino-/benzoyl-pyrroles
;
_journal_issue                   55
_journal_name_full               'Chemical Communications'
_journal_page_first              10162
_journal_page_last               10165
_journal_paper_doi               10.1039/D5CC00956A
_journal_volume                  61
_journal_year                    2025
_chemical_formula_moiety         'C15 H13 N O2 S'
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_atom_sites_solution_hydrogens   geom
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_audit_update_record
;
2024-12-31 deposited with the CCDC.	2025-05-23 downloaded from the CCDC.
;
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_computing_cell_refinement       '<i>SAINT</i> (Bruker, 2016)'
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_diffrn_measurement_method       '\w and \f'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_point_group_measured_fraction_full 0.999
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_exptl_absorpt_process_details
;
 SADABS 2016/2: Krause, L., Herbst-Irmer, R., Sheldrick G.M. & Stalke D.,
 J. Appl. Cryst. 48 (2015) 3-10
;
_exptl_crystal_colour            COLOURLESS
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0511P)^2^+0.9131P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_gt                1549
_reflns_number_total             2674
_reflns_threshold_expression     'I > 2\s(I)'
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_cod_depositor_comments
'Adding full bibliography for 7134643--7134645.cif.'
_cod_original_sg_symbol_H-M      'C 2/c'
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