Reversible piezofluorochromism of a triphenylamine-based benzothiazole derivative with a strong fluorescence response to volatile acid vapors
Zhan, Yong; Yang, Peng; Li, Gang; Zhang, Yuanyuan; Bao, Ying; New J. Chem. 41 (2017) 263–; doi:10.1039/C6NJ02735K

data_7055870
_publ_section_title
;
 Reversible piezofluorochromism of a triphenylamine-based benzothiazole
 derivative with a strong fluorescence response to volatile acid vapors
;
_journal_issue                   1
_journal_name_full               'New J. Chem.'
_journal_page_first              263
_journal_paper_doi               10.1039/C6NJ02735K
_journal_volume                  41
_journal_year                    2017
_chemical_formula_sum            'C33 H24 N2 S'
_chemical_formula_weight         480.60
_chemical_name_systematic
(E)-4-(4-(benzo[d]thiazol-2-yl)styryl)-N,N-diphenylaniline
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
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_symmetry_space_group_name_Hall  '-P 1'
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_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2016-11-04 deposited with the CCDC.
2016-11-20 downloaded from the CCDC.
;
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_cell_length_b                   10.5329(6)
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_cell_volume                     2504.9(3)
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      273(2)
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_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Xcalibur, Eos'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_limit_h_max       11
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_diffrn_reflns_point_group_measured_fraction_full 0.999
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_diffrn_reflns_theta_max         24.710
_diffrn_reflns_theta_min         2.144
_diffrn_source                   'Enhance (Mo) X-ray Source'
_exptl_absorpt_coefficient_mu    0.154
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.274
_exptl_crystal_description       block
_exptl_crystal_F_000             1008
_exptl_crystal_preparation       ', Luminescent'
_refine_diff_density_max         0.536
_refine_diff_density_min         -0.388
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_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0751P)^2^+1.1720P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_gt                4313
_reflns_number_total             8515
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c6nj02735k2.cif
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_cod_depositor_comments          'Adding full bibliography for 7055870.cif.'
_cod_database_code               7055870
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