Defective plane induced fractal TON zeolites for efficient hydroisomerization of long-chain hydrocarbons.
Liu, Li; Xie, Haodong; Ni, Xiang; Yang, Xue; Liu, Yan; Ma, Yufang; Yuan, Feixiang; Tao, Shuo; Wang, Lei; Zhu, Hongjun; Nanoscale 17 (2025) 11049–11059; doi:10.1039/d5nr00443h

data_1575052
_publ_section_title
;
 Defective plane induced fractal TON zeolites for efficient
 hydroisomerization of long-chain hydrocarbons.
;
_journal_issue                   17
_journal_name_full               Nanoscale
_journal_page_first              11049
_journal_page_last               11059
_journal_paper_doi               10.1039/d5nr00443h
_journal_volume                  17
_journal_year                    2025
_chemical_formula_moiety
'B0.05 O6.03 Si2.96, 0.023(C5 H8 N2), O0.03, 0.09(H)'
_chemical_formula_sum            'C0.11 H0.27 B0.05 N0.05 O6.05 Si2.96'
_chemical_formula_weight         181.75
_chemical_name_common            Borosilicate_TON_50
_space_group_IT_number           36
_space_group_name_Hall           'C 2c -2'
_space_group_name_H-M_alt        'C m c 21'
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      36
_symmetry_space_group_name_Hall  'C 2c -2'
_symmetry_space_group_name_H-M   'C m c 21'
_audit_update_record
;
2024-09-02 deposited with the CCDC.	2025-03-31 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   13.7710(2)
_cell_length_b                   17.3783(2)
_cell_length_c                   5.02140(10)
_cell_measurement_reflns_used    573
_cell_measurement_temperature    298
_cell_measurement_theta_max      60
_cell_measurement_theta_min      2.5
_cell_volume                     1201.70(3)
_computing_structure_refinement  TOPAS
_diffrn_ambient_temperature      298
_diffrn_measurement_device_type  STOE
_diffrn_radiation_probe          x-ray
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_type           'Cu Kalpha1'
_diffrn_radiation_wavelength     1.540598
_diffrn_reflns_theta_max         60
_diffrn_reflns_theta_min         2.5
_exptl_absorpt_coefficient_mu    7.070
_exptl_crystal_colour            White
_exptl_crystal_density_diffrn    2.009
_exptl_crystal_description       Plate
_exptl_crystal_F_000             726.8
_pd_proc_ls_prof_R_factor        0.02423
_pd_proc_ls_prof_wR_expected     0.01763
_pd_proc_ls_prof_wR_factor       0.03993
_refine_ls_goodness_of_fit_all   2.264
_refine_ls_hydrogen_treatment    mixed
_refine_ls_number_parameters     117
_refine_ls_number_reflns         537
_refine_ls_R_I_factor            0.04297
_refine_ls_shift/su_max          0.001
_cod_data_source_file            d5nr00443h2.cif
_cod_data_source_block           borosilicate_TON_50
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_diffrn_radiation_probe' value 'X-ray' was changed to
'x-ray' in accordance with the
/home/data/users/saulius/crontab/automatic-downloads/current/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 8170 2020-07-09 18:12:32Z antanas 
;
_cod_database_code               1575052