Photoresponsive europium(III) complex based on photochromic reaction.
Nakagawa, Tetsuya; Hasegawa, Yasuchika; Kawai, Tsuyoshi; The journal of physical chemistry. A 112 (2008) 5096–5103; doi:10.1021/jp712079n

data_1504369
_publ_section_title
;
 Photoresponsive europium(III) complex based on photochromic reaction.
;
_journal_issue                   23
_journal_name_full               'The journal of physical chemistry. A'
_journal_page_first              5096
_journal_page_last               5103
_journal_paper_doi               10.1021/jp712079n
_journal_volume                  112
_journal_year                    2008
_chemical_formula_moiety         'C29 H21 N3 S3 '
_chemical_formula_sum            'C29 H21 N3 S3'
_chemical_formula_weight         507.69
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.0000
_cell_angle_beta                 97.4801(14)
_cell_angle_gamma                90.0000
_cell_formula_units_Z            4
_cell_length_a                   13.4193(7)
_cell_length_b                   10.3767(5)
_cell_length_c                   17.7646(8)
_cell_measurement_reflns_used    17822
_cell_measurement_temperature    173.1
_cell_measurement_theta_max      27.4
_cell_measurement_theta_min      3.0
_cell_volume                     2452.6(2)
_computing_cell_refinement       PROCESS-AUTO
_computing_data_collection       PROCESS-AUTO
_computing_data_reduction        CrystalStructure
_computing_publication_material  'CrystalStructure 3.8'
_computing_structure_refinement  CRYSTALS
_computing_structure_solution    SIR92
_diffrn_detector_area_resol_mean 10.00
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.042
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            22950
_diffrn_reflns_theta_full        27.42
_diffrn_reflns_theta_max         27.42
_exptl_absorpt_coefficient_mu    0.326
_exptl_absorpt_correction_T_max  0.943
_exptl_absorpt_correction_T_min  0.597
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
    Higashi, T. (1995). Program for Absorption Correction.
    Rigaku Corporation, Tokyo, Japan.
;
_exptl_crystal_colour            darkblue
_exptl_crystal_density_diffrn    1.375
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1056.00
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.18
_refine_diff_density_max         1.33
_refine_diff_density_min         -0.49
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.002
_refine_ls_hydrogen_treatment    refall
_refine_ls_number_parameters     337
_refine_ls_number_reflns         4051
_refine_ls_R_factor_gt           0.0625
_refine_ls_shift/su_max          0.0000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[0.0066Fo^2^ + 1.0000\s(Fo^2^)]/(4Fo^2^)'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.1944
_reflns_number_gt                4028
_reflns_number_total             5568
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            jp712079n-file006.cif
_cod_data_source_block           '_terthia'
_cod_original_formula_sum        'C29 H21 N3 S3 '
_cod_database_code               1504369