Directional Energy Transfer in Mixed-Metallic Copper(I)-Silver(I) Coordination Polymers with Strong Luminescence.
Shibata, Seiko; Tsuge, Kiyoshi; Sasaki, Yoichi; Ishizaka, Shoji; Kitamura, Noboru; Inorganic chemistry 54 (2015) 9733–9739; doi:10.1021/acs.inorgchem.5b01224

data_4346285
_publ_section_title
;
 Directional Energy Transfer in Mixed-Metallic Copper(I)-Silver(I)
 Coordination Polymers with Strong Luminescence.
;
_journal_issue                   20
_journal_name_full               'Inorganic chemistry'
_journal_page_first              9733
_journal_page_last               9739
_journal_paper_doi               10.1021/acs.inorgchem.5b01224
_journal_volume                  54
_journal_year                    2015
_chemical_formula_moiety         'C46 H38 Ag1.70 Cu0.30 I2 N2 P2'
_chemical_formula_sum            'C46 H38 Ag1.7 Cu0.3 I2 N2 P2'
_chemical_formula_weight         1137.02
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                105.1218(7)
_cell_angle_beta                 108.9574(7)
_cell_angle_gamma                92.6425(8)
_cell_formula_units_Z            1
_cell_length_a                   9.20397(17)
_cell_length_b                   9.64432(17)
_cell_length_c                   13.1673(3)
_cell_measurement_reflns_used    9115
_cell_measurement_temperature    153
_cell_measurement_theta_max      68.25
_cell_measurement_theta_min      3.71
_cell_volume                     1056.12(4)
_computing_cell_refinement       'RAPID AUTO'
_computing_data_collection       'RAPID AUTO (Rigaku, ????)'
_computing_data_reduction        'RAPID AUTO'
_computing_molecular_graphics    'CrystalStructure 4.0'
_computing_publication_material  'CrystalStructure 4.0 (Rigaku, 2010)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      153
_diffrn_detector_area_resol_mean 10.000
_diffrn_measured_fraction_theta_full 0.980
_diffrn_measured_fraction_theta_max 0.980
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Cu K\a'
_diffrn_radiation_wavelength     1.54187
_diffrn_reflns_av_R_equivalents  0.1104
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            12098
_diffrn_reflns_theta_full        68.25
_diffrn_reflns_theta_max         68.25
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    18.950
_exptl_absorpt_correction_T_max  0.150
_exptl_absorpt_correction_T_min  0.087
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'ABSCOR (Rigaku, 1995)'
_exptl_crystal_colour            'pale yellow'
_exptl_crystal_density_diffrn    1.788
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             552.60
_exptl_crystal_size_max          0.170
_exptl_crystal_size_mid          0.150
_exptl_crystal_size_min          0.100
_refine_diff_density_max         1.520
_refine_diff_density_min         -1.580
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.067
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_parameters     245
_refine_ls_number_reflns         3786
_refine_ls_number_restraints     0
_refine_ls_R_factor_gt           0.0525
_refine_ls_shift/su_max          0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[\s^2^(Fo^2^)+(0.0595P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.1431
_reflns_number_gt                3221
_reflns_number_total             3786
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            ic5b01224_si_003.cif
_cod_data_source_block           mix15p_CuAg
_cod_original_formula_sum        'C46 H38 Ag1.70 Cu0.30 I2 N2 P2'
_cod_database_code               4346285