Rhodium-Catalyzed Amidation of the Cage B(4)‒H Bond in o-Carboranes with Dioxazolones by Carboxylic Acid-Assisted B(4)‒H Bond Activation
Baek, Yonghyeon; Kim, Suhui; Son, Jeong-Yu; Lee, Kooyeon; Kim, Dongwook; Lee, Phil Ho; ACS Catalysis  (2019) 10418–; doi:10.1021/acscatal.9b03380

data_4514437
_publ_section_title
;
 Rhodium-Catalyzed Amidation of the Cage B(4)--H Bond in o-Carboranes with
 Dioxazolones by Carboxylic Acid-Assisted B(4)--H Bond Activation
;
_journal_name_full               'ACS Catalysis'
_journal_page_first              10418
_journal_paper_doi               10.1021/acscatal.9b03380
_journal_year                    2019
_chemical_formula_sum            'C10 H19 B10 N O'
_chemical_formula_weight         277.36
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_cell_length_b                   16.7722(10)
_cell_length_c                   20.1088(11)
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_diffrn_reflns_theta_min         3.163
_diffrn_source                   'fine-focus sealed tube'
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_exptl_absorpt_correction_T_max  0.7457
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_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colourless
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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^)+(0.0661P)^2^+1.0465P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1225
_refine_ls_wR_factor_ref         0.1445
_reflns_Friedel_coverage         0.000
_reflns_number_gt                2648
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            cs9b03380_si_002.cif
_cod_data_source_block           A19026O_061
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'MULTI-SCAN' changed to
'multi-scan' according to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/ACS/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 
;
_cod_database_code               4514437
_shelx_shelxl_version_number     2018/3
_shelx_estimated_absorpt_t_min   0.978
_shelx_estimated_absorpt_t_max   0.993
_shelx_res_checksum              82040
_shelx_hkl_checksum              46842