Crown ether-based hamburger POMOF combined with polypyrrole as a highly reversible lithium-ion battery anode material.
Zhang, Hui; Ren, Zhujuan; Yu, Jiaying; Wang, Kuaibing; Mao, Feifei; Wu, Hua; Dalton transactions (Cambridge, England : 2003) 54 (2025) 10280–10293; doi:10.1039/d5dt00584a

data_7718857
_publ_section_title
;
 Crown ether-based hamburger POMOF combined with polypyrrole as a highly
 reversible lithium-ion battery anode material.
;
_journal_issue                   26
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              10280
_journal_page_last               10293
_journal_paper_doi               10.1039/d5dt00584a
_journal_volume                  54
_journal_year                    2025
_chemical_formula_sum            'C48 H68 Cu4 Mo8 N8 O30'
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_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2024-02-26 deposited with the CCDC.	2025-05-16 downloaded from the CCDC.
;
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_cell_volume                     6057.64(17)
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
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_diffrn_measured_fraction_theta_full 0.996
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_diffrn_radiation_type           MoK\a
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_refine_diff_density_max         0.988
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_refine_ls_extinction_method     none
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_refine_ls_hydrogen_treatment    constr
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_refine_ls_restrained_S_all      0.791
_refine_ls_R_factor_all          0.0718
_refine_ls_R_factor_gt           0.0342
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0260P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0616
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_reflns_threshold_expression     'I > 2\s(I)'
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_cod_data_source_block           shelx
_cod_depositor_comments          'Adding full bibliography for 7718857.cif.'
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               7718857
_shelx_shelxl_version_number     2014/7
_shelx_res_checksum              30130
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