Enantiopure and racemic radical-cation salts of B(malate)2(-) anions with BEDT-TTF.
Lopez, Jordan R.; Martin, Lee; Wallis, John D.; Akutsu, Hiroki; Nakazawa, Yasuhiro; Yamada, Jun-Ichi; Kadoya, Tomofumi; Coles, Simon J.; Wilson, Claire; Dalton transactions (Cambridge, England : 2003) 45 (2016) 9285–9293; doi:10.1039/c6dt01038e

data_7039245
_publ_section_title
;
 Enantiopure and racemic radical-cation salts of B(malate)2(-) anions with
 BEDT-TTF.
;
_journal_issue                   22
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              9285
_journal_page_last               9293
_journal_paper_doi               10.1039/c6dt01038e
_journal_volume                  45
_journal_year                    2016
_chemical_formula_moiety         '2(C10 H8 S8), C8 H8 B O10, 2.72(H2 O)'
_chemical_formula_sum            'C28 H29.44 B O12.72 S16'
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_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   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_update_record
;
2016-03-14 deposited with the CCDC.
2016-05-10 downloaded from the CCDC.
;
_cell_angle_alpha                76.855(5)
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_cell_angle_gamma                70.436(5)
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_computing_cell_refinement       'RAPID AUTO'
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_computing_structure_refinement  'SHELXL Version 2013/4 (Sheldrick, 2008)'
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_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.0268
_diffrn_reflns_Laue_measured_fraction_full 0.995
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_diffrn_reflns_number            19802
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_exptl_crystal_description       platelet
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_exptl_crystal_size_mid          0.100
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_refine_ls_structure_factor_coef Fsqd
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'w = 1/[\s^2^(Fo^2^)+(0.0582P)^2^+2.1443P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_threshold_expression     F^2^>2.0\s(F^2^)
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_cod_depositor_comments
'Adding full bibliography for 7039244--7039246.cif.'
_cod_original_cell_volume        2058.16(16)
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