Side-on coordination of boryl and borylene complexes to cationic coinage metal fragments
Braunschweig, Holger; Radacki, Krzysztof; Shang, Rong; Chem. Sci. 6 (2015) 2989–; doi:10.1039/C5SC00211G

data_1518831
_publ_section_title
;
 Side-on coordination of boryl and borylene complexes to cationic coinage
 metal fragments
;
_journal_issue                   5
_journal_name_full               'Chem. Sci.'
_journal_page_first              2989
_journal_paper_doi               10.1039/C5SC00211G
_journal_volume                  6
_journal_year                    2015
_chemical_formula_moiety
'C29 H34 B2 Cu2 Mn3 O6, C24 H12 B Cl8, 2(C7 H8)'
_chemical_formula_sum            'C67 H62 B3 Cl8 Cu2 Mn3 O6'
_chemical_formula_weight         1571.09
_chemical_name_systematic        11'
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_secondary   iterative
_audit_creation_method           SHELXL-2014/6
_audit_update_record
;
2014-11-07 deposited with the CCDC.
2015-03-09 downloaded from the CCDC.
;
_cell_angle_alpha                97.172(14)
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_cell_measurement_temperature    100(2)
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_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker D8 Quest'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_Laue_measured_fraction_full 0.999
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'Re-crystallisation from solvent: toluene'
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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^)+(0.0690P)^2^+8.4452P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_threshold_expression     'I > 2\s(I)'
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_cod_depositor_comments
'Adding full bibliography for 1518822--1518832.cif.'
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_cod_database_code               1518831
_shelx_estimated_absorpt_t_min   0.636
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_shelx_res_checksum              34684