Triazole vs. triazolium carbene ligands in the site-selective cyclometallation of o-carboranes by M(iii) (M = Ir, Rh) complexes.
Frutos, María; Gómez-Gallego, Mar; Giner, Elena A.; Sierra, Miguel A.; Ramírez de Arellano, Carmen; Dalton transactions (Cambridge, England : 2003) 47 (2018) 9975–9979; doi:10.1039/c8dt02296h

data_7046897
_publ_section_title
;
 Triazole vs. triazolium carbene ligands in the site-selective
 cyclometallation of o-carboranes by M(iii) (M = Ir, Rh) complexes.
;
_journal_issue                   30
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              9975
_journal_page_last               9979
_journal_paper_doi               10.1039/c8dt02296h
_journal_volume                  47
_journal_year                    2018
_chemical_formula_sum            'C25 H37 B10 Cl Fe Ir N3'
_chemical_formula_weight         771.17
_chemical_name_common            MAS_fplh9cbIR
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2017/1
_audit_update_record
;
2018-05-04 deposited with the CCDC.
2018-06-22 downloaded from the CCDC.
;
_cell_angle_alpha                90
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_cell_measurement_temperature    120(2)
_cell_measurement_theta_max      30.034
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_cell_volume                     3048.9(5)
_computing_cell_refinement       'HKL Scalepack (Otwinowski & Minor 1997)'
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_computing_structure_refinement  'SHELXL-2017/1 (Sheldrick, 2017)'
_computing_structure_solution    'SHELXS-2013 (Sheldrick, 2013)'
_diffrn_ambient_temperature      120(2)
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_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  KappaCCD
_diffrn_measurement_method       CCD
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_diffrn_reflns_av_R_equivalents  0.0422
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_exptl_crystal_description       prism
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_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0362P)^2^] where P=(Fo^2^+2Fc^2^)/3'
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c8dt02296h2.cif
_cod_data_source_block           fplh9cbIr
_cod_depositor_comments
'Adding full bibliography for 7046897--7046898.cif.'
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