Modulation of the ligand-based fluorescence of 3d metal complexes upon spin state change
Charles Lochenie; Kristina G. Wagner; Matthias Karg; Birgit Weber; Journal of Materials Chemistry C 3 (2015) 7925–7935; doi:10.1039/C5TC00837A

data_7234377
_publ_section_title
;
 Modulation of the ligand-based fluorescence of 3d metal complexes upon
 spin state change
;
_journal_name_full               'Journal of Materials Chemistry C'
_journal_page_first              7925
_journal_page_last               7935
_journal_paper_doi               10.1039/C5TC00837A
_journal_volume                  3
_journal_year                    2015
_chemical_formula_moiety         'C30 H32 Cl6 Cu N4 O7'
_chemical_formula_sum            'C30 H32 Cl6 Cu N4 O7'
_chemical_formula_weight         836.83
_chemical_name_common            '[CuL26a(EtOH)]2CHCl3'
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_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
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_cell_angle_beta                 86.734(12)
_cell_angle_gamma                88.122(12)
_cell_formula_units_Z            2
_cell_length_a                   8.651(1)
_cell_length_b                   11.798(2)
_cell_length_c                   18.199(3)
_cell_measurement_reflns_used    9058
_cell_measurement_temperature    133(2)
_cell_measurement_theta_max      27.25
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_computing_cell_refinement       X-AREA-STOE
_computing_data_collection       X-AREA-STOE
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_computing_molecular_graphics    ORTEP-III
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_computing_structure_solution    SIR97
_diffrn_ambient_temperature      133(2)
_diffrn_detector_area_resol_mean 9
_diffrn_measured_fraction_theta_full 0.958
_diffrn_measured_fraction_theta_max 0.893
_diffrn_measurement_device_type  STOE-STADIVARI
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_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
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_diffrn_reflns_av_unetI/netI     0.1677
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_diffrn_reflns_limit_h_max       8
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_diffrn_reflns_limit_k_min       -13
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_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    1.126
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    1.577
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             854
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_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.2000P)^2^] where P=(Fo^2^+2Fc^2^)/3'
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_cod_original_cell_volume        1761.8(4)
_cod_database_code               7234377
_shelxl_version_number           2014-3
_shelx_res_checksum              35909
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