Regioselective synthesis of ortho-iodobiphenylboronic acid derivatives: a superior catalyst for carboxylic acid activation
Al-Zoubi, Raed M.; Al-Jammal, Walid K.; McDonald, Robert; New Journal of Chemistry 44 (2020) 3612–3623; doi:10.1039/C9NJ05708K

data_7059264
_publ_section_title
;
 Regioselective synthesis of ortho-iodobiphenylboronic acid derivatives: a
 superior catalyst for carboxylic acid activation
;
_journal_issue                   9
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              3612
_journal_page_last               3623
_journal_paper_doi               10.1039/C9NJ05708K
_journal_volume                  44
_journal_year                    2020
_chemical_formula_moiety         'C14 H14 B I O4'
_chemical_formula_sum            'C14 H14 B I O4'
_chemical_formula_weight         383.96
_chemical_name_common            (19A)
_chemical_name_systematic
'(2-iodo-4',5-dimethoxybiphenyl-3-yl)boronic acid'
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
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_atom_sites_solution_hydrogens   mixed
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_audit_update_record
;
2018-11-28 deposited with the CCDC.	2020-01-31 downloaded from the CCDC.
;
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_cell_measurement_temperature    193(2)
_cell_measurement_theta_max      28.07
_cell_measurement_theta_min      2.24
_cell_volume                     712.47(5)
_computing_cell_refinement       'Bruker SAINT'
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_computing_structure_solution    'DIRDIF-2008 (Beurskens et al., 2008)'
_diffrn_ambient_temperature      193(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       '\w scans'
_diffrn_radiation_type           MoK\a
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_exptl_absorpt_correction_T_min  0.7538
_exptl_absorpt_correction_type   numerical
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_exptl_crystal_colour            colourless
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_exptl_crystal_description       fragment
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'Re-crystallisation from solvent: Hexanes'
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_refine_ls_number_restraints     2
_refine_ls_restrained_S_all      1.070
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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^)+(0.0229P)^2^+0.3304P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0485
_refine_ls_wR_factor_ref         0.0499
_reflns_Friedel_coverage         0.000
_reflns_number_gt                3235
_reflns_number_total             3500
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c9nj05708k2.cif
_cod_data_source_block           jus1508
_cod_depositor_comments
;Adding full bibliography for 7059263--7059266.cif.

 Adding full bibliography for 7059263--7059266.cif.
;
_cod_database_code               7059264
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_shelx_res_checksum              76183