Covalent Post-assembly Modification Triggers Structural Transformations of Borromean Rings.
Gao, Wen-Xi; Feng, Hui-Jun; Lin, Yue-Jian; Jin, Guo-Xin; Journal of the American Chemical Society 141 (2019) 9160–9164; doi:10.1021/jacs.9b02985

data_4128722
_publ_section_title
;
 Covalent Post-assembly Modification Triggers Structural Transformations
 of Borromean Rings.
;
_journal_issue                   23
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              9160
_journal_page_last               9164
_journal_paper_doi               10.1021/jacs.9b02985
_journal_volume                  141
_journal_year                    2019
_chemical_formula_sum            'C104 H140 F12 N12 O38 Pd2 Rh4 S6'
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_atom_sites_solution_hydrogens   geom
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_cell_angle_beta                 93.396(4)
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_cell_length_c                   37.548(8)
_cell_measurement_reflns_used    9952
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_cell_measurement_theta_min      2.22
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_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.985
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
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_diffrn_reflns_Laue_measured_fraction_full 0.994
_diffrn_reflns_Laue_measured_fraction_max 0.985
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_diffrn_reflns_theta_max         26.784
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_exptl_absorpt_correction_T_max  0.745
_exptl_absorpt_correction_T_min  0.296
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            orange
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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^)+(0.1569P)^2^+377.0703P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_gt                22783
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_reflns_threshold_expression     'I > 2\s(I)'
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_cod_data_source_block           mo_80506a_sq
_cod_original_sg_symbol_H-M      'C 2/c'
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_shelx_estimated_absorpt_t_min   0.618
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_shelx_fab_checksum              57207