Reactivity of titanium pyrazolates towards CO<sub>2</sub>, CS<sub>2</sub> and N<sub>2</sub>O.
Kracht, Felix; Mayer, Sophie; Maichle-Mössmer, Cäcilia; Anwander, Reiner; Dalton transactions (Cambridge, England : 2003) 54 (2025) 10890–10897; doi:10.1039/d5dt00957j

data_7718937
_publ_section_title
;
 Reactivity of titanium pyrazolates towards CO<sub>2</sub>, CS<sub>2</sub>
 and N<sub>2</sub>O.
;
_journal_issue                   28
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              10890
_journal_page_last               10897
_journal_paper_doi               10.1039/d5dt00957j
_journal_volume                  54
_journal_year                    2025
_chemical_formula_sum            'C41 H50 N12 O9 Ti2'
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_chemical_properties_physical    Air-sensitive,Moisture-sensitive
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_atom_sites_solution_hydrogens   geom
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_audit_update_record
;
2025-02-14 deposited with the CCDC.	2025-06-23 downloaded from the CCDC.
;
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_diffrn_source                   'ImuS-focus sealed tube'
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_exptl_crystal_colour            yellow
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_exptl_crystal_description       plate
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_refine_ls_R_factor_gt           0.0502
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0523P)^2^+2.3774P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_refine_ls_wR_factor_ref         0.1316
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_reflns_number_gt                6418
_reflns_number_total             9977
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d5dt00957j2.cif
_cod_data_source_block           2_mo_fk156_0m
_cod_depositor_comments
'Adding full bibliography for 7718936--7718941.cif.'
_cod_original_cell_volume        4510.0(11)
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               7718937
_shelx_shelxl_version_number     2014/7
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_shelx_estimated_absorpt_t_max   0.978
_shelx_res_checksum              12832
_shelx_hkl_checksum              16878