Synthesis and crystal structure of a luminescent infinite 2D brick-wall network with two- and three-coordinate silver(I) atoms and ligand-unsupported silver‒silver interactions
Fei, Bao-Li; Sun, Wei-Yin; Okamura, Taka-aki; Tang, Wen-Xia; Ueyama, Norikazu; New Journal of Chemistry 25 (2001) 210–; doi:10.1039/b008266j

data_7051057
_publ_section_title
;
 Synthesis and crystal structure of a luminescent infinite 2D
 brick-wall network with two- and three-coordinate silver(I) atoms and
 ligand-unsupported silver--silver interactions
;
_journal_issue                   2
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              210
_journal_paper_doi               10.1039/b008266j
_journal_volume                  25
_journal_year                    2001
_chemical_formula_moiety         'C31 H40 Ag3 Cl3 N8.50 O2 '
_chemical_formula_sum            'C31 H41.5 Ag3 Cl3 N8.5 O12'
_chemical_formula_weight         1155.18
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                100.50(3)
_cell_angle_beta                 102.23(2)
_cell_angle_gamma                97.16(2)
_cell_formula_units_Z            2
_cell_length_a                   13.612(2)
_cell_length_b                   15.789(4)
_cell_length_c                   10.172(4)
_cell_measurement_reflns_used    24
_cell_measurement_temperature    298.2
_cell_measurement_theta_max      16.7
_cell_measurement_theta_min      15.0
_cell_volume                     2070.2(11)
_computing_cell_refinement       WinAFC
_computing_data_collection       WinAFC
_computing_data_reduction        'teXsan Ver. 1.10'
_computing_publication_material  'teXsan Ver. 1.10'
_computing_structure_refinement  'teXsan Ver. 1.10'
_computing_structure_solution    SHELXS97
_diffrn_measured_fraction_theta_full 1.0000
_diffrn_measured_fraction_theta_max 1.0000
_diffrn_measurement_device_type  'Rigaku AFC7R'
_diffrn_measurement_method       \w-2\q
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.022
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            10049
_diffrn_reflns_theta_full        27.51
_diffrn_reflns_theta_max         27.51
_diffrn_standards_decay_%        1.21
_diffrn_standards_interval_count 150
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    1.663
_exptl_absorpt_correction_T_max  0.847
_exptl_absorpt_correction_T_min  0.449
_exptl_absorpt_correction_type   psi-scan
_exptl_absorpt_process_details   '(North, Phillips & Mathews, 1968)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.853
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_size_max          0.500
_exptl_crystal_size_mid          0.500
_exptl_crystal_size_min          0.100
_refine_diff_density_max         0.95
_refine_diff_density_min         -0.82
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.063
_refine_ls_hydrogen_treatment    noref
_refine_ls_number_parameters     513
_refine_ls_number_reflns         9511
_refine_ls_R_factor_gt           0.0421
_refine_ls_shift/su_max          0.0085
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[\s^2^(Fo^2^) + (0.06000(Max(Fo^2^,0) + 2Fc^2^)/3)^2^]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.1517
_reflns_number_gt                4002
_reflns_number_total             9511
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            b008266j.txt
_cod_data_source_block           '[Ag3(pyCH2NHCH2CH2CH2NHCH2'
_cod_original_cell_volume        2070(1)
_cod_original_sg_symbol_H-M      'P -1         '
_cod_original_formula_sum        'C31 H41.50 Ag3 Cl3 N8.50 O12 '
_cod_database_code               7051057