Bridging coordination of acenaphthylene to a Pd<sub>3</sub> chain or a Pd<sub>4</sub> sheet cluster.
Yamamoto, Koji; Sugawa, Tsuyoshi; Kondo, Mio; Masaoka, Shigeyuki; Murahashi, Tetsuro; Dalton transactions (Cambridge, England : 2003) 51 (2022) 1901–1906; doi:10.1039/d1dt04071e

data_7709296
_publ_section_title
;
 Bridging coordination of acenaphthylene to a Pd<sub>3</sub> chain or a
 Pd<sub>4</sub> sheet cluster.
;
_journal_issue                   5
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              1901
_journal_page_last               1906
_journal_paper_doi               10.1039/d1dt04071e
_journal_volume                  51
_journal_year                    2022
_chemical_formula_moiety         'C71.5 H62 Cl F12 P4 Pd4'
_chemical_formula_sum            'C71.5 H62 Cl F12 P4 Pd4'
_chemical_formula_weight         1734.21
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_update_record
;
2021-10-19 deposited with the CCDC.	2021-12-20 downloaded from the CCDC.
;
_cell_angle_alpha                115.3717(9)
_cell_angle_beta                 97.0350(12)
_cell_angle_gamma                90.4714(12)
_cell_formula_units_Z            2
_cell_length_a                   10.7362(4)
_cell_length_b                   18.4776(6)
_cell_length_c                   19.2924(6)
_cell_measurement_reflns_used    38746
_cell_measurement_temperature    165
_cell_measurement_theta_max      27.55
_cell_measurement_theta_min      3.00
_cell_volume                     3424.2(2)
_computing_cell_refinement       'RAPID AUTO'
_computing_data_collection       'RAPID AUTO (Rigaku, ????)'
_computing_data_reduction        'RAPID AUTO'
_computing_molecular_graphics    'CrystalStructure 4.3'
_computing_publication_material  'CrystalStructure 4.3 (Rigaku, 2018)'
_computing_structure_refinement  'SHELXL Version 2017/1 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT Version 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      165
_diffrn_detector_area_resol_mean 10.000
_diffrn_measured_fraction_theta_full 0.990
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.0647
_diffrn_reflns_av_unetI/netI     0.0540
_diffrn_reflns_Laue_measured_fraction_full 0.990
_diffrn_reflns_Laue_measured_fraction_max 0.987
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            60364
_diffrn_reflns_point_group_measured_fraction_full 0.990
_diffrn_reflns_point_group_measured_fraction_max 0.987
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.484
_diffrn_reflns_theta_min         3.003
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.241
_exptl_absorpt_correction_T_max  0.857
_exptl_absorpt_correction_T_min  0.524
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'ABSCOR (Rigaku, 1995)'
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    1.682
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1720.00
_exptl_crystal_size_max          0.239
_exptl_crystal_size_mid          0.127
_exptl_crystal_size_min          0.124
_refine_diff_density_max         2.52
_refine_diff_density_min         -1.65
_refine_ls_extinction_method     none
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_refine_ls_hydrogen_treatment    constr
_refine_ls_number_parameters     837
_refine_ls_number_reflns         15467
_refine_ls_number_restraints     184
_refine_ls_R_factor_all          0.0823
_refine_ls_R_factor_gt           0.0668
_refine_ls_shift/su_max          0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[\s^2^(Fo^2^)+(0.1079P)^2^+22.6097P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1996
_refine_ls_wR_factor_ref         0.2125
_reflns_Friedel_coverage         0.000
_reflns_number_gt                12308
_reflns_number_total             15467
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            d1dt04071e2.cif
_cod_data_source_block           acenaph718
_cod_depositor_comments
'Adding full bibliography for 7709295--7709296.cif.'
_cod_original_cell_volume        3424.1(2)
_cod_database_code               7709296
_shelx_res_checksum              65218
_shelx_hkl_checksum              30326