Nanoheterogeneous catalysis in electrochemically induced olefin perfluoroalkylation.
Dudkina, Yulia B.; Gryaznova, Tatyana V.; Osin, Yuri N.; Salnikov, Vadim V.; Davydov, Nikolay A.; Fedorenko, Svetlana V.; Mustafina, Asia R.; Vicic, David A.; Sinyashin, Oleg G.; Budnikova, Yulia H.; Dalton transactions (Cambridge, England : 2003) 44 (2015) 8833–8838; doi:10.1039/c5dt00269a

data_7034671
_publ_section_title
;
 Nanoheterogeneous catalysis in electrochemically induced olefin
 perfluoroalkylation.
;
_journal_issue                   19
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              8833
_journal_page_last               8838
_journal_paper_doi               10.1039/c5dt00269a
_journal_volume                  44
_journal_year                    2015
_chemical_formula_moiety         'C32 H26 F24'
_chemical_formula_sum            'C32 H26 F24'
_chemical_formula_weight         866.53
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2015-03-24 deposited with the CCDC.
2015-04-01 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 99.686(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   27.503(2)
_cell_length_b                   11.0537(9)
_cell_length_c                   11.5143(9)
_cell_measurement_reflns_used    9841
_cell_measurement_temperature    135(2)
_cell_measurement_theta_max      26.58
_cell_measurement_theta_min      3.13
_cell_volume                     3450.6(5)
_computing_cell_refinement       'APEX2  v2, 1-4  (Bruker AXS, 2005-2007)'
_computing_data_collection       'APEX2  v2, 1-4  (Bruker AXS, 2005-2007)'
_computing_data_reduction        'SAINT NT v6.0 (Bruker AXS, 2003)'
_computing_molecular_graphics    'ORTEP-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'enCIFer (Allen et al. 2004)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      135(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device       'Bruker D8 QUEST CCD'
_diffrn_measurement_method       '\w scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0540
_diffrn_reflns_av_sigmaI/netI    0.0448
_diffrn_reflns_limit_h_max       36
_diffrn_reflns_limit_h_min       -35
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            55864
_diffrn_reflns_theta_full        27.84
_diffrn_reflns_theta_max         27.84
_diffrn_reflns_theta_min         2.91
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    0.188
_exptl_absorpt_correction_T_max  0.9925
_exptl_absorpt_correction_T_min  0.9563
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
'SADABS version 2.10 (Sheldrick,Bruker AXS Inc.)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.668
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1736
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.04
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_refine_diff_density_min         -0.403
_refine_diff_density_rms         0.072
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.043
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     519
_refine_ls_number_reflns         8158
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.043
_refine_ls_R_factor_all          0.1366
_refine_ls_R_factor_gt           0.0735
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.1175P)^2^+3.4077P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2002
_refine_ls_wR_factor_ref         0.2405
_reflns_number_gt                4583
_reflns_number_total             8158
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c5dt00269a2.cif
_cod_data_source_block           ssrr1a
_cod_depositor_comments
'Adding full bibliography for 7034670--7034671.cif.'
_cod_original_cell_volume        3450.5(5)
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               7034671