Direct micro-scale monitoring of molecular aggregation, its growth and diffusion via aggregation-induced emission.
Jyothi, Mane; Annadhasan, Mari; Vinay Pradeep, Vuppu; Chandrasekar, Rajadurai; Soft matter 16 (2020) 2664–2668; doi:10.1039/d0sm00108b

data_1557386
_publ_section_title
;
 Direct micro-scale monitoring of molecular aggregation, its growth and
 diffusion via aggregation-induced emission.
;
_journal_issue                   11
_journal_name_full               'Soft matter'
_journal_page_first              2664
_journal_page_last               2668
_journal_paper_doi               10.1039/d0sm00108b
_journal_volume                  16
_journal_year                    2020
_chemical_formula_moiety         'C23 H12 Br F6 N'
_chemical_formula_sum            'C23 H12 Br F6 N'
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_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2019-12-13 deposited with the CCDC.	2020-02-25 downloaded from the CCDC.
;
_cell_angle_alpha                90
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_exptl_absorpt_correction_type   multi-scan
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_exptl_crystal_description       block
_exptl_crystal_F_000             1968
_exptl_crystal_size_max          0.180
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_refine_ls_extinction_coef       0.0038(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
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_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.023
_refine_ls_R_factor_all          0.1443
_refine_ls_R_factor_gt           0.0736
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0688P)^2^+21.2989P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1628
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_reflns_Friedel_coverage         0.000
_reflns_number_gt                2414
_reflns_number_total             4256
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d0sm00108b1.cif
_cod_data_source_block           shelx
_cod_depositor_comments          'Adding full bibliography for 1557386.cif.'
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               1557386
_shelx_shelxl_version_number     2014/7
_shelx_estimated_absorpt_t_min   0.709
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_shelx_res_checksum              57449