Copper(I) complexes bearing pyrrole-bridged S,N and N-donor ligands as catalysts for tandem hydroamination-alkynylation: effect of anions on product formation.
Mondal, Munmun; Mani, Ganesan; Dalton transactions (Cambridge, England : 2003) 53 (2024) 13996–14010; doi:10.1039/d4dt01937g

data_7716735
_publ_section_title
;
 Copper(I) complexes bearing pyrrole-bridged S,N and N-donor ligands as
 catalysts for tandem hydroamination-alkynylation: effect of anions on
 product formation.
;
_journal_issue                   33
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              13996
_journal_page_last               14010
_journal_paper_doi               10.1039/d4dt01937g
_journal_volume                  53
_journal_year                    2024
_chemical_formula_sum            'C16 H40 Cl6 Cu2 N4 O4'
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_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2019/3
_audit_update_record
;
2024-04-17 deposited with the CCDC.	2024-07-25 downloaded from the CCDC.
;
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_cell_angle_gamma                90
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_diffrn_measurement_device_type  'D8 QUEST'
_diffrn_measurement_method       '\w scans'
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_diffrn_reflns_av_R_equivalents  0.0768
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_diffrn_reflns_Laue_measured_fraction_full 0.998
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_diffrn_reflns_theta_min         2.147
_diffrn_source                   'Fine focused sealed tube'
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_exptl_crystal_colour            'light yellow'
_exptl_crystal_density_diffrn    1.620
_exptl_crystal_description       prism
_exptl_crystal_F_000             712
_exptl_crystal_size_max          0.152
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_refine_ls_restrained_S_all      1.037
_refine_ls_R_factor_all          0.0495
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_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0391P)^2^+0.3092P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0796
_refine_ls_wR_factor_ref         0.0877
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4366
_reflns_number_total             5431
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d4dt01937g2.cif
_cod_data_source_block           morpholiniumcation
_cod_depositor_comments
'Adding full bibliography for 7716734--7716739.cif.'
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               7716735
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