C–C Cleavage Approach to C–H Functionalization of Saturated Aza-Cycles
Roque, Jose B.; Kuroda, Yusuke; Jurczyk, Justin; Xu, Li-Ping; Ham, Jin Su; Göttemann, Lucas T.; Roberts, Charis A.; Adpressa, Donovon; Saurí, Josep; Joyce, Leo A.; Musaev, Djamaladdin G.; Yeung, Charles S.; Sarpong, Richmond; ACS Catalysis  (2020) 2929–2941; doi:10.1021/acscatal.9b04551

data_4517427
_publ_section_title
;
 C--C Cleavage Approach to C--H Functionalization of Saturated Aza-Cycles
;
_journal_name_full               'ACS Catalysis'
_journal_page_first              2929
_journal_page_last               2941
_journal_paper_doi               10.1021/acscatal.9b04551
_journal_year                    2020
_chemical_formula_sum            'C13 H15 N O2'
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_chemical_name_common            jr001
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_diffrn_ambient_temperature      100(2)
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_diffrn_measured_fraction_theta_full 1.000
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_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
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_exptl_absorpt_correction_T_max  0.746
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_refine_ls_R_factor_all          0.0503
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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^)+(0.0585P)^2^+0.3987P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            cs9b04551_si_002.cif
_cod_data_source_block           jr001
_cod_depositor_comments
'Adding full bibliography for 4517425--4517427.cif.'
_cod_original_cell_volume        1125.21(15)
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4517427
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_shelx_estimated_absorpt_t_max   0.996
_shelx_res_checksum              49779
_shelx_hkl_checksum              11305