Latency control of chemical reactions in polymerization of epoxy resins using a hydrogen bonding network
Haneda, Tsuyoshi; Matsuno, Shinya; Yamamoto, Hisanao; Ohtsu, Hiroyoshi; Kawano, Masaki; CrystEngComm 23 (2021) 7717–7719; doi:10.1039/D1CE01163D

data_7243836
_publ_section_title
;
 Latency control of chemical reactions in polymerization of epoxy resins
 using a hydrogen bonding network
;
_journal_issue                   44
_journal_name_full               CrystEngComm
_journal_page_first              7717
_journal_page_last               7719
_journal_paper_doi               10.1039/D1CE01163D
_journal_volume                  23
_journal_year                    2021
_chemical_formula_sum            'C48 H81 O8 P2'
_chemical_formula_weight         848.099
_chemical_name_common            TBP
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_audit_update_record
;
2021-02-03 deposited with the CCDC.	2021-10-14 downloaded from the CCDC.
;
_cell_angle_alpha                83.576(1)
_cell_angle_beta                 93.435(1)
_cell_angle_gamma                109.149(2)
_cell_formula_units_Z            1
_cell_length_a                   13.8216(4)
_cell_length_b                   10.5310(3)
_cell_length_c                   9.5380(2)
_cell_measurement_temperature    300
_cell_volume                     1302.86(6)
_computing_cell_refinement       'RIETAN-FP (Izumi and Momma, 2007)'
_computing_molecular_graphics    'VESTA (Momma and Izumi, 2008)'
_computing_structure_refinement  'RIETAN-FP (Izumi and Momma, 2007)'
_diffrn_ambient_temperature      300
_diffrn_measurement_device_type  CCD
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     1.770000
_diffrn_source                   'Synchrotron radiation'
_diffrn_source_type              'aichiSR BL5S2'
_exptl_absorpt_coefficient_mu    1.628
_exptl_crystal_density_diffrn    1.0809
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       ?????
_exptl_crystal_F_000             463.00
_pd_calc_method                  'Rietveld Refinement'
_pd_instr_location               ' ?'
_pd_meas_2theta_range_inc        0.0100
_pd_meas_2theta_range_max        60.0000
_pd_meas_2theta_range_min        5.0000
_pd_meas_number_of_points        5501
_pd_meas_scan_method             step
_pd_proc_2theta_range_inc        0.0100
_pd_proc_2theta_range_max        60.0000
_pd_proc_2theta_range_min        5.0000
_pd_proc_ls_background_function  'Legendre polynomials'
_pd_proc_ls_pref_orient_corr     ' ?'
_pd_proc_ls_profile_function     'split pseudo-Voigt function'
_pd_proc_ls_prof_R_factor        0.04788
_pd_proc_ls_prof_wR_expected     0.00875
_pd_proc_ls_prof_wR_factor       0.03793
_pd_spec_mounting                ' ?'
_pd_spec_mount_mode              transmission
_pd_spec_shape                   cylinder
_refine_diff_density_max         0.0
_refine_diff_density_min         0.0
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   4.3378
_refine_ls_matrix_type           full
_refine_ls_number_constraints    69
_refine_ls_number_parameters     107
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.02813
_refine_ls_R_Fsqd_factor         0.02811
_refine_ls_R_I_factor            0.06802
_refine_ls_shift/su_max          0.0
_refine_ls_weighting_details     1/<i>y</i>~i~
_refine_ls_weighting_scheme      sigma
_cod_data_source_file            d1ce01163d2.cif
_cod_data_source_block           single_phase_CCDC1
_cod_depositor_comments
'Adding full bibliography for 7243835--7243841.cif.'
_cod_original_cell_volume        1302.87(5)
_cod_database_code               7243836