Synthesis of a xanthene-based macrocyclic imine ligand and two-step planarization by metalation with Ni<sup>2+</sup> and Na<sup/>.
Akine, Shigehisa; Nakano, Masato; Sakata, Yoko; Tsuzuki, Seiji; Dalton transactions (Cambridge, England : 2003) 54 (2025) 11573–11580; doi:10.1039/d5dt01183c

data_7719065
_publ_section_title
;
 Synthesis of a xanthene-based macrocyclic imine ligand and two-step
 planarization by metalation with Ni<sup>2+</sup> and Na<sup/>.
;
_journal_issue                   30
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              11573
_journal_page_last               11580
_journal_paper_doi               10.1039/d5dt01183c
_journal_volume                  54
_journal_year                    2025
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_chemical_name_common            C46H36N4O6(CHCl3)0.5(MeCN)2.5
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_audit_update_record
;
2025-05-05 deposited with the CCDC.	2025-07-07 downloaded from the CCDC.
;
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_exptl_absorpt_correction_type   multi-scan
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_exptl_crystal_description       prismatic
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'Re-crystallisation from solvent: CHCl3/MeCN'
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_refine_ls_restrained_S_all      1.078
_refine_ls_R_factor_all          0.0749
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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^)+(0.0915P)^2^+4.5007P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_refine_ls_wR_factor_ref         0.1804
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_reflns_number_gt                6616
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d5dt01183c2.cif
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_cod_depositor_comments
'Adding full bibliography for 7719065--7719067.cif.'
_cod_original_cell_volume        4390.2(10)
_cod_original_sg_symbol_H-M      'P 21/m'
_cod_original_formula_sum        'C51.50 H44 Cl1.50 N6.50 O6'
_cod_database_code               7719065
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_shelx_res_checksum              9330
_shelx_hkl_checksum              37015