Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl amidinate complex.
Settineri, Nicholas S.; Arnold, John; Chemical science 9 (2018) 2831–2841; doi:10.1039/c7sc05328b

data_1548918
_publ_section_title
;
 Insertion, protonolysis and photolysis reactivity of a thorium monoalkyl
 amidinate complex.
;
_journal_issue                   10
_journal_name_full               'Chemical science'
_journal_page_first              2831
_journal_page_last               2841
_journal_paper_doi               10.1039/c7sc05328b
_journal_volume                  9
_journal_year                    2018
_chemical_formula_sum            'C35 H69 N9 Si Th'
_chemical_formula_weight         876.12
_chemical_name_systematic        Th(ptolylN3CH2SiMe3)(BIMA)3
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2017-12-14 deposited with the CCDC.
2018-02-16 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 95.127(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4
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_cell_length_c                   21.7432(12)
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_diffrn_measured_fraction_theta_max 0.989
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
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_diffrn_radiation_type           MoK\a
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_diffrn_reflns_av_unetI/netI     0.0371
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_diffrn_reflns_limit_l_min       0
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_diffrn_reflns_theta_min         1.210
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_exptl_absorpt_correction_T_max  0.745
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0236P)^2^+12.8275P] where P=(Fo^2^+2Fc^2^)/3'
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_reflns_number_total             15081
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c7sc05328b2.cif
_cod_data_source_block           Th(ptolylN3CH2TMS)(BIMA)3
_cod_depositor_comments
'Adding full bibliography for 1548917--1548927.cif.'
_cod_database_code               1548918
_shelx_shelxl_version_number     2014/7
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_shelx_res_checksum              50992