Synthesis and reactivity at the Ir-<sup>Me</sup>Tpm platform: from κ<sup>1</sup>-N coordination to κ<sup>3</sup>-N-based organometallic chemistry.
Fernández-Alvarez, Francisco J; Polo, Víctor; García-Orduña, Pilar; Lahoz, Fernando J.; Pérez-Torrente, Jesús J; Oro, Luis A.; Lalrempuia, Ralte; Dalton transactions (Cambridge, England : 2003) 48 (2019) 6455–6463; doi:10.1039/c9dt00703b

data_7049425
_publ_section_title
;
 Synthesis and reactivity at the Ir-<sup>Me</sup>Tpm platform: from
 \k<sup>1</sup>-N coordination to \k<sup>3</sup>-N-based organometallic
 chemistry.
;
_journal_issue                   19
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              6455
_journal_page_last               6463
_journal_paper_doi               10.1039/c9dt00703b
_journal_volume                  48
_journal_year                    2019
_chemical_formula_moiety         'C25 H38 Ir N6 O, C F3 O3 S'
_chemical_formula_sum            'C26 H38 F3 Ir N6 O4 S'
_chemical_formula_weight         779.88
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_space_group_name_Hall           '-P 1'
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_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   mixed
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;
2017-12-21 deposited with the CCDC.    2019-03-25 downloaded from the CCDC.
;
_cell_angle_alpha                75.6490(10)
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_cell_length_b                   9.7845(4)
_cell_length_c                   19.0733(7)
_cell_measurement_reflns_used    9948
_cell_measurement_temperature    100(2)
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_cell_volume                     1470.69(10)
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'SAINT+ in APEX2 v. 2008.4 (Bruker AXS, 2008)'
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'SAINT+ in APEX2 v. 2008.4 (Bruker AXS, 2008)'
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_diffrn_measurement_device_type  'Bruker APEX DUO CCD system'
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_diffrn_reflns_Laue_measured_fraction_full 1.000
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_diffrn_reflns_limit_h_min       -11
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_diffrn_reflns_limit_l_max       26
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_diffrn_reflns_number            17642
_diffrn_reflns_point_group_measured_fraction_full 1.000
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;
 SADABS: Area-Detector Absorption Correction. (1996) Bruker-AXS 
 within APEX2 package.
;
_exptl_crystal_colour            white
_exptl_crystal_density_diffrn    1.761
_exptl_crystal_description       prism
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'Re-crystallisation from solvent: dichloromethane / pentane'
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_refine_ls_R_factor_all          0.0199
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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^)+(0.0216P)^2^+1.7063P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_refine_ls_wR_factor_ref         0.0472
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_reflns_number_gt                7264
_reflns_number_total             7487
_reflns_threshold_expression     'I > 2\s(I)'
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_cod_depositor_comments
'Adding full bibliography for 7049422--7049425.cif.'
_cod_database_code               7049425
_shelxl_version_number           2014-3
_shelx_res_checksum              64405