Synthesis, structural analysis, DFT study, and catalytic performance of a glycine-Schiff base binuclear copper(ii) complex
López-Gastélum, Karla-Alejandra; Chávez-Urías, Iván-Fernando; López-González, Luis E.; García, Juventino J.; Flores-Alamo, Marcos; Morales-Morales, David; Galindo, Jordi R.; Sugich-Miranda, Rocío; Medrano Valenzuela, Felipe; Velázquez-Contreras, Enrique F.; Rocha-Alonzo, Fernando; New Journal of Chemistry 48 (2024) 18569–18579; doi:10.1039/D4NJ03659J

data_7063492
_publ_section_title
;
 Synthesis, structural analysis, DFT study, and catalytic performance of a
 glycine-Schiff base binuclear copper(ii) complex
;
_journal_issue                   43
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              18569
_journal_page_last               18579
_journal_paper_doi               10.1039/D4NJ03659J
_journal_volume                  48
_journal_year                    2024
_chemical_formula_sum            'C9 H10 Cu N2 O7'
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2024-08-12 deposited with the CCDC.	2024-10-15 downloaded from the CCDC.
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        CrysAlisPro, Agilent Technologies,
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        CrysAlisPro, Agilent Technologies,
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        CrysAlisPro, Agilent Technologies,
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          'Ortep-3 for Windows (Farrugia, 1997)'
      L. J. Farrugia, J. Appl. Crystallogr., 1997, 30, 565.
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        L. J. Farrugia, WinGX and ORTEP for Windows: an update, 
	J. Appl. Cryst. 45 (2012)  849-854.   
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      'SHELXS-2018 (Sheldrick, 2015)'
      Sheldrick, G. M. (2015). Acta Cryst. C71, 3--8.
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      'SHELXS-2018 (Sheldrick, 2015)'
      Sheldrick, G. M. (2015). Acta Cryst. A71, 3--8.
;
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        CrysAlisPro, Agilent Technologies,
        Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
        (compiled Aug  2 2013,16:46:58)
        Analytical numeric absorption correction using a multifaceted crystal
                        model based on expressions derived by R.C. Clark & J.S.
        (Clark, R. C. & Reid, J. S. (1995). Acta Cryst. A51, 887-897)
;
_exptl_crystal_colour            'dark green'
_exptl_crystal_density_diffrn    1.909
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_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0327P)^2^+0.2984P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_Friedel_coverage         0
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d4nj03659j2.cif
_cod_data_source_block           CCDC-snglyc
_cod_depositor_comments          'Adding full bibliography for 7063492.cif.'
_cod_original_cell_volume        559.58(14)
_cod_database_code               7063492
_shelx_estimated_absorpt_t_min   0.437
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