Luminescent cyclic trinuclear coinage metal complexes with aggregation-induced emission (AIE) performance.
Tian, Yuan; Wang, Zhao-Yang; Zang, Shuang-Quan; Li, Dan; Mak, Thomas C. W.; Dalton transactions (Cambridge, England : 2003) 48 (2019) 2275–2279; doi:10.1039/c8dt04898c

data_7048522
_publ_section_title
;
 Luminescent cyclic trinuclear coinage metal complexes with
 aggregation-induced emission (AIE) performance.
;
_journal_issue                   7
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              2275
_journal_page_last               2279
_journal_paper_doi               10.1039/c8dt04898c
_journal_volume                  48
_journal_year                    2019
_chemical_formula_moiety         'C96 H81 Ag3 N6'
_chemical_formula_sum            'C96 H81 Ag3 N6'
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_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2013
_audit_update_record
;
2019-01-05 deposited with the CCDC.
2019-01-10 downloaded from the CCDC.
;
_cell_angle_alpha                73.420(3)
_cell_angle_beta                 88.480(3)
_cell_angle_gamma                78.205(3)
_cell_formula_units_Z            2
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_cell_measurement_temperature    200(10)
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_cell_volume                     4447.2(3)
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_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_diffrn_ambient_temperature      200(10)
_diffrn_measured_fraction_theta_full 0.987
_diffrn_measured_fraction_theta_max 0.829
_diffrn_measurement_device_type  'XtaLAB AFC12 (RINC): Kappa single'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_av_R_equivalents  0.0995
_diffrn_reflns_av_unetI/netI     0.1708
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_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       40
_diffrn_reflns_limit_l_min       -33
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_diffrn_reflns_point_group_measured_fraction_full 0.987
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_diffrn_reflns_theta_max         29.208
_diffrn_reflns_theta_min         2.121
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;
CrysAlisPro 1.171.39.28b (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colorless
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_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
;
 w=1/[\s^2^(Fo^2^)+(0.0518P)^2^]
 where P=(Fo^2^+2Fc^2^)/3
;
_refine_ls_weighting_scheme      calc
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_reflns_number_gt                9676
_reflns_number_total             19998
_reflns_threshold_expression     'I > 2\s(I)'
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'Adding full bibliography for 7048520--7048522.cif.'
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