A remote nonconjugated electron effect in insertion polymerization with α-diimine nickel and palladium species
Li, Shuaikang; Xu, Guoyong; Dai, Shengyu; Polymer Chemistry 11 (2020) 2692–2699; doi:10.1039/D0PY00218F

data_1557601
_publ_section_title
;
 A remote nonconjugated electron effect in insertion polymerization with
 \a-diimine nickel and palladium species
;
_journal_issue                   15
_journal_name_full               'Polymer Chemistry'
_journal_page_first              2692
_journal_page_last               2699
_journal_paper_doi               10.1039/D0PY00218F
_journal_volume                  11
_journal_year                    2020
_chemical_formula_sum            'C77 H67 Cl F8 N2 Pd'
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_audit_update_record
;
2020-02-09 deposited with the CCDC.	2020-03-12 downloaded from the CCDC.
;
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_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
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_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'CCD area detector'
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_diffrn_radiation_monochromator  graphite
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_diffrn_reflns_limit_k_min       -36
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_diffrn_reflns_limit_l_min       -17
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_diffrn_reflns_theta_full        25.02
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_diffrn_reflns_theta_min         2.22
_exptl_absorpt_coefficient_mu    0.340
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_exptl_absorpt_correction_T_min  0.9050
_exptl_absorpt_correction_type   multi-scan
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_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.155
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
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;
;
_refine_diff_density_max         0.786
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_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.1470P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2685
_refine_ls_wR_factor_ref         0.2977
_reflns_number_gt                7449
_reflns_number_total             13322
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            d0py00218f2.cif
_cod_data_source_block           190923a
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_symmetry_cell_setting' value 'Monoclinic' was changed to
'monoclinic' in accordance with the
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 7556 2019-12-06 15:28:31Z antanas 

 Adding full bibliography for 1557600--1557601.cif.

 Adding full bibliography for 1557600--1557601.cif.
;
_cod_original_cell_volume        7557.7(11)
_cod_original_sg_symbol_H-M      P2(1)/c
_cod_database_code               1557601