Rhodium-catalyzed triazole-directed C-H bond functionalization of arenes with diazo compounds.
Wang, Huanhong; Yi, Xiaofei; Cui, Yanli; Chen, Wanzhi; Organic & biomolecular chemistry 16 (2018) 8191–8195; doi:10.1039/c8ob01673a

data_7156520
_publ_section_title
;
 Rhodium-catalyzed triazole-directed C-H bond functionalization of arenes
 with diazo compounds.
;
_journal_issue                   43
_journal_name_full               'Organic &amp; biomolecular chemistry'
_journal_page_first              8191
_journal_page_last               8195
_journal_paper_doi               10.1039/c8ob01673a
_journal_volume                  16
_journal_year                    2018
_chemical_formula_sum            'C27 H33 Cl N3 O Rh'
_chemical_formula_weight         553.92
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
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_audit_update_record
;
2018-06-08 deposited with the CCDC.
2018-10-17 downloaded from the CCDC.
;
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_cell_length_c                   13.403(2)
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_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
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_exptl_absorpt_correction_T_max  0.8734
_exptl_absorpt_correction_T_min  0.7373
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            Orange
_exptl_crystal_density_diffrn    1.397
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Plate
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0361P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0864
_refine_ls_wR_factor_ref         0.0995
_reflns_number_gt                3582
_reflns_number_total             4612
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c8ob01673a2.cif
_cod_data_source_block           180115_whh20180105_1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 

 Adding full bibliography for 7156520--7156522.cif.
;
_cod_original_cell_volume        1317.2(3)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7156520