Dienamine-Catalyzed Nitrone Formation via Redox Reaction.
Fraboni, Americo J.; Brenner-Moyer, Stacey E; Organic letters 18 (2016) 2146–2149; doi:10.1021/acs.orglett.6b00770

data_1555538
_publ_section_title
;
 Dienamine-Catalyzed Nitrone Formation via Redox Reaction.
;
_journal_issue                   9
_journal_name_full               'Organic letters'
_journal_page_first              2146
_journal_page_last               2149
_journal_paper_doi               10.1021/acs.orglett.6b00770
_journal_volume                  18
_journal_year                    2016
_chemical_formula_moiety         'C12 H13 N O2'
_chemical_formula_sum            'C12 H13 N O2'
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_cell_angle_beta                 99.596(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4
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_cell_length_b                   8.8394(15)
_cell_length_c                   12.567(2)
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_cell_measurement_theta_max      37.81
_cell_measurement_theta_min      2.83
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_computing_structure_solution    'SHELXT (Sheldrick, 2014)'
_diffrn_ambient_temperature      100.0(5)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.979
_diffrn_measurement_device_type  'Bruker SMART APEX II CCD platform'
_diffrn_measurement_method       '\w scans'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_av_unetI/netI     0.0365
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_diffrn_reflns_Laue_measured_fraction_max 0.979
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       15
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_diffrn_reflns_limit_l_min       -22
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_diffrn_reflns_point_group_measured_fraction_full 1.000
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_diffrn_source                   'fine-focus sealed tube'
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_exptl_absorpt_correction_T_max  0.7476
_exptl_absorpt_correction_T_min  0.6170
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_exptl_absorpt_process_details   'SADABS (Sheldrick, 2014)'
_exptl_crystal_colour            'light yellow'
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_refine_ls_extinction_method     none
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_refine_ls_hydrogen_treatment    refall
_refine_ls_matrix_type           full
_refine_ls_number_parameters     188
_refine_ls_number_reflns         5928
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.029
_refine_ls_R_factor_all          0.0776
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_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^)+(0.0713P)^2^+0.1395P] where P=(Fo^2^+2Fc^2^)/3'
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_reflns_number_total             5928
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            ol6b00770_si_003.cif
_cod_data_source_block           rutsbm01
_cod_original_cell_volume        1074.2(3)
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               1555538
_shelx_shelxl_version_number     2014/7
_shelx_estimated_absorpt_t_min   0.963
_shelx_estimated_absorpt_t_max   0.986
_shelx_res_checksum              13515
_shelx_hkl_checksum              15910