Fluorescein hydrazone-based supramolecular architectures, molecular recognition, sequential logic operation and cell imaging
Tripathi, Kamini; Rai, Abhishek; Yadav, Amarish Kumar; Srikrishna, Saripella; Kumari, Niraj; Mishra, Lallan; RSC Adv. 7 (2017) 2264–; doi:10.1039/C6RA26255D

data_7227423
_publ_section_title
;
 Fluorescein hydrazone-based supramolecular architectures, molecular
 recognition, sequential logic operation and cell imaging
;
_journal_issue                   4
_journal_name_full               'RSC Adv.'
_journal_page_first              2264
_journal_paper_doi               10.1039/C6RA26255D
_journal_volume                  7
_journal_year                    2017
_chemical_formula_sum            'C43 H53 N5 O10'
_chemical_formula_weight         799.90
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2016-09-06 deposited with the CCDC.
2016-12-01 downloaded from the CCDC.
;
_cell_angle_alpha                84.161(4)
_cell_angle_beta                 86.179(4)
_cell_angle_gamma                77.400(4)
_cell_formula_units_Z            2
_cell_length_a                   8.2826(5)
_cell_length_b                   13.7434(7)
_cell_length_c                   19.0467(9)
_cell_measurement_reflns_used    6069
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.3090
_cell_measurement_theta_min      3.3950
_cell_volume                     2102.7(2)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.873
_diffrn_measurement_device_type  'Xcalibur, Sapphire3'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0324
_diffrn_reflns_av_sigmaI/netI    0.0470
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            28490
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         29.35
_diffrn_reflns_theta_min         3.05
_exptl_absorpt_coefficient_mu    0.090
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.82922
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.263
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       rectangular
_exptl_crystal_F_000             852
_exptl_crystal_size_max          0.42
_exptl_crystal_size_mid          0.39
_exptl_crystal_size_min          0.36
_refine_diff_density_max         0.557
_refine_diff_density_min         -0.476
_refine_diff_density_rms         0.047
_refine_ls_extinction_coef       0.0018(9)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.042
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     531
_refine_ls_number_reflns         10085
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.042
_refine_ls_R_factor_all          0.1219
_refine_ls_R_factor_gt           0.0813
_refine_ls_shift/su_max          0.082
_refine_ls_shift/su_mean         0.002
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0698P)^2^+1.5920P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1842
_refine_ls_wR_factor_ref         0.2087
_reflns_number_gt                6650
_reflns_number_total             10085
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c6ra26255d2.cif
_cod_data_source_block           fkcn
_cod_original_cell_volume        2102.71(19)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7227423