Brilliant reversible luminescent mechanochromism of silver(I) complexes containing o-bis(diphenylphosphino)benzene and phosphinesulfide.
Tsukuda, Toshiaki; Kawase, Marina; Dairiki, Ayumi; Matsumoto, Kenji; Tsubomura, Taro; Chemical communications (Cambridge, England) 46 (2010) 1905–1907; doi:10.1039/b921111j

data_7105287
_publ_section_title
;
 Brilliant reversible luminescent mechanochromism of silver(I)
 complexes containing o-bis(diphenylphosphino)benzene and
 phosphinesulfide.
;
_journal_issue                   11
_journal_name_full
'Chemical communications (Cambridge, England)'
_journal_page_first              1905
_journal_page_last               1907
_journal_paper_doi               10.1039/b921111j
_journal_volume                  46
_journal_year                    2010
_chemical_formula_moiety         'C54 H44 Ag N P4 S2 '
_chemical_formula_sum            'C54 H44 Ag N P4 S2'
_chemical_formula_weight         1002.83
_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                76.752(5)
_cell_angle_beta                 82.344(6)
_cell_angle_gamma                73.936(5)
_cell_formula_units_Z            2
_cell_length_a                   11.445(2)
_cell_length_b                   13.553(2)
_cell_length_c                   16.038(3)
_cell_measurement_reflns_used    5735
_cell_measurement_temperature    123.1
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.1
_cell_volume                     2320.5(7)
_computing_cell_refinement       CrystalClear
_computing_data_collection       CrystalClear
_computing_data_reduction        CrystalStructure
_computing_publication_material  'CrystalStructure 3.8'
_computing_structure_refinement  SHELXL
_computing_structure_solution    SIR2004
_diffrn_ambient_temperature      123.1
_diffrn_detector_area_resol_mean 7.31
_diffrn_measured_fraction_theta_full 0.962
_diffrn_measured_fraction_theta_max 0.919
_diffrn_measurement_device_type  'Rigaku Saturn'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.0185
_diffrn_reflns_av_sigmaI/netI    0.0255
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            21470
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         27.48
_exptl_absorpt_coefficient_mu    0.701
_exptl_absorpt_correction_T_max  0.9022
_exptl_absorpt_correction_T_min  0.8443
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details
;
Higashi, T. (1999). Program for Absorption Correction.
Rigaku Corporation, Tokyo, Japan.
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.435
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1028.00
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.243
_refine_diff_density_min         -0.451
_refine_diff_density_rms         0.062
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.046
_refine_ls_hydrogen_treatment    refall
_refine_ls_number_parameters     560
_refine_ls_number_reflns         9762
_refine_ls_restrained_S_all      1.046
_refine_ls_R_factor_all          0.0349
_refine_ls_R_factor_gt           0.0293
_refine_ls_shift/su_max          0.0020
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[\s^2^(Fo^2^)+(0.0332P)^2^+1.8134P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0697
_refine_ls_wR_factor_ref         0.0727
_reflns_number_gt                8668
_reflns_number_total             9762
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            b921111j.txt
_cod_data_source_block           AgdppbzdppaS2blueemissive
_cod_original_formula_sum        'C54 H44 Ag N P4 S2 '
_cod_database_code               7105287