Dienaminodioate based multicomponent reactions with post-benzylic oxidative transformations mediated by DDQ.
Ravindran, Jaice; Yadhukrishnan, Velickakathu O.; Asha, Reghuvaran S.; Lankalapalli, Ravi S.; Organic & biomolecular chemistry 18 (2020) 3927–3937; doi:10.1039/d0ob00721h

data_7157493
_publ_section_title
;
 Dienaminodioate based multicomponent reactions with post-benzylic
 oxidative transformations mediated by DDQ.
;
_journal_issue                   20
_journal_name_full               'Organic &amp; biomolecular chemistry'
_journal_page_first              3927
_journal_page_last               3937
_journal_paper_doi               10.1039/d0ob00721h
_journal_volume                  18
_journal_year                    2020
_chemical_formula_moiety         'C24 H19 N O6'
_chemical_formula_sum            'C24 H19 N O6'
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_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2018-12-12 deposited with the CCDC.	2020-05-06 downloaded from the CCDC.
;
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_cell_angle_gamma                84.193(4)
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_cell_measurement_theta_min      2.49
_cell_volume                     1008.49(15)
_computing_cell_refinement       'APEX2/SAINT (Bruker, 2004)'
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_computing_molecular_graphics
'ORTEP3 (Farrugia, 1997) and Mercury (Bruno et al., 2002)'
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_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker axs kappa apex2 CCD Diffractometer'
_diffrn_measurement_method       '\w and \f scan'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_limit_k_min       -12
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_exptl_crystal_description       block
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_exptl_crystal_size_max          0.200
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_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_goodness_of_fit_ref   1.051
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
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_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.051
_refine_ls_R_factor_all          0.0828
_refine_ls_R_factor_gt           0.0433
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0550P)^2^+0.2718P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1025
_refine_ls_wR_factor_ref         0.1287
_reflns_Friedel_coverage         0.000
_reflns_number_gt                2255
_reflns_number_total             3551
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d0ob00721h2.cif
_cod_data_source_block           JR749
_cod_depositor_comments
'Adding full bibliography for 7157493--7157494.cif.'
_cod_database_code               7157493
_shelx_shelxl_version_number     2014/7
_shelx_estimated_absorpt_t_min   0.980
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_shelx_res_checksum              4533