Formation of a highly-ordered rigid multichromophoric 3D supramolecular network by combining ionic and coordination-driven self-assembly.
Kaloudi-Chantzea, Antonia; Martinou, Elisabeth; Seintis, Kostas; Karakostas, Nikolaos; Giastas, Petros; Pitterl, Florian; Oberacher, Herbert; Fakis, Mihalis; Pistolis, George; Chemical communications (Cambridge, England) 52 (2016) 3388–3391; doi:10.1039/c5cc10335e

data_7118608
_publ_section_title
;
 Formation of a highly-ordered rigid multichromophoric 3D supramolecular
 network by combining ionic and coordination-driven self-assembly.
;
_journal_issue                   16
_journal_name_full
'Chemical communications (Cambridge, England)'
_journal_page_first              3388
_journal_page_last               3391
_journal_paper_doi               10.1039/c5cc10335e
_journal_volume                  52
_journal_year                    2016
_chemical_formula_sum            'C1401 H1152 B16 N125 O181 P32 Pt16 S32'
_chemical_formula_weight         27945.84
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           56
_symmetry_space_group_name_Hall  '-P 2ab 2ac'
_symmetry_space_group_name_H-M   'P c c n'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2015-11-02 deposited with the CCDC.
2016-01-25 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            1
_cell_length_a                   31.680(6)
_cell_length_b                   38.340(8)
_cell_length_c                   41.120(8)
_cell_measurement_temperature    293(2)
_cell_volume                     49945(17)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_wavelength     0.75600
_diffrn_reflns_av_R_equivalents  0.0926
_diffrn_reflns_av_sigmaI/netI    0.0709
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_k_max       34
_diffrn_reflns_limit_k_min       -34
_diffrn_reflns_limit_l_max       35
_diffrn_reflns_limit_l_min       -37
_diffrn_reflns_number            71689
_diffrn_reflns_theta_full        20.10
_diffrn_reflns_theta_max         20.10
_diffrn_reflns_theta_min         0.89
_exptl_absorpt_coefficient_mu    1.226
_exptl_crystal_density_diffrn    0.929
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             14201
_refine_diff_density_max         1.424
_refine_diff_density_min         -0.791
_refine_diff_density_rms         0.203
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.299
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1490
_refine_ls_number_reflns         19489
_refine_ls_number_restraints     554
_refine_ls_restrained_S_all      1.305
_refine_ls_R_factor_all          0.1915
_refine_ls_R_factor_gt           0.1252
_refine_ls_shift/su_max          7.125
_refine_ls_shift/su_mean         0.131
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.2000P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2421
_refine_ls_wR_factor_ref         0.2880
_reflns_number_gt                10317
_reflns_number_total             19489
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c5cc10335e2.cif
_cod_data_source_block           1st-coot-8_copy_of_7
_cod_depositor_comments          'Adding full bibliography for 7118608.cif.'
_cod_database_code               7118608