Silver(I) Coordination Polymers of Fluorescent Oligo(phenylenevinylene) with π-π Stackings: Luminescence and Conductivity
Shu Qin Liu; Takayoshi Kuroda-Sowa; Hisashi Konaka; Yusaku Suenaga; Masahiko Maekawa; Tomonari Mizutani; Gui Ling Ning; Megumu Munakata; Inorganic Chemistry 44 (2005) 1031–1036; doi:10.1021/ic0400585

data_4308527
_publ_section_title
;
Silver(I) Coordination Polymers of Fluorescent Oligo(phenylenevinylene)
with \p-\p Stackings: Luminescence and Conductivity
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1031
_journal_page_last               1036
_journal_paper_doi               10.1021/ic0400585
_journal_volume                  44
_journal_year                    2005
_chemical_formula_moiety         'C34 H30 Ag2 F6 O6 S2 '
_chemical_formula_sum            'C34 H30 Ag2 F6 O6 S2'
_chemical_formula_weight         928.45
_space_group_IT_number           13
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      13
_symmetry_space_group_name_Hall  '-P 2yac'
_symmetry_space_group_name_H-M   'P 1 2/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 101.229(7)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   12.588(2)
_cell_length_b                   5.0727(5)
_cell_length_c                   28.600(4)
_cell_measurement_reflns_used    4215
_cell_measurement_temperature    295.2
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.0
_cell_volume                     1791.3(4)
_computing_cell_refinement       CRYSTALCLEAR
_computing_data_collection       CRYSTALCLEAR
_computing_data_reduction        'teXsan Ver. 1.11'
_computing_publication_material  'teXsan Ver. 1.11'
_computing_structure_refinement  SHELXL97
_computing_structure_solution    SHELXS97
_diffrn_detector_area_resol_mean 14.62
_diffrn_measured_fraction_theta_full 1.00
_diffrn_measured_fraction_theta_max 1.00
_diffrn_measurement_device_type  'Rigaku/MSC Mercury CCD'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.037
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       6
_diffrn_reflns_limit_k_min       -6
_diffrn_reflns_limit_l_max       36
_diffrn_reflns_limit_l_min       -37
_diffrn_reflns_number            13936
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_exptl_absorpt_coefficient_mu    1.280
_exptl_absorpt_correction_T_max  0.880
_exptl_absorpt_correction_T_min  0.715
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(Jacobson, 1998)'
_exptl_crystal_colour            Yellow
_exptl_crystal_density_diffrn    1.721
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             924.0
_exptl_crystal_size_max          0.400
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.100
_refine_diff_density_max         0.33
_refine_diff_density_min         -0.39
_refine_ls_extinction_coef       0.0000
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.151
_refine_ls_hydrogen_treatment    noref
_refine_ls_number_parameters     226
_refine_ls_number_reflns         3175
_refine_ls_R_factor_gt           0.0512
_refine_ls_shift/su_max          0.0010
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[\s^2^(Fo^2^) + (0.0376P)^2^+0.7970P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.1022
_reflns_number_gt                3175
_reflns_number_total             4104
_reflns_threshold_expression     >2.0sigma(I)
_cod_data_source_file            ic0400585_s1_1.cif
_cod_data_source_block           '[Ag2(bdb)(CF3SO3)2]'
_cod_original_cell_volume        1791.4(4)
_cod_original_formula_sum        'C34 H30 Ag2 F6 O6 S2 '
_cod_database_code               4308527