Synthesis of 1,2-biphenylethane based single-molecule diodes.
Galán, Elena; Perrin, Mickael L.; Lutz, Martin; van der Zant, Herre S. J.; Grozema, Ferdinand C.; Eelkema, Rienk; Organic & biomolecular chemistry 14 (2016) 2439–2443; doi:10.1039/c6ob00008h

data_7154920
_publ_section_title
;
 Synthesis of 1,2-biphenylethane based single-molecule diodes.
;
_journal_issue                   8
_journal_name_full               'Organic &amp; biomolecular chemistry'
_journal_page_first              2439
_journal_page_last               2443
_journal_paper_doi               10.1039/c6ob00008h
_journal_volume                  14
_journal_year                    2016
_chemical_formula_moiety         'C14 H10 Br2 F2'
_chemical_formula_sum            'C14 H10 Br2 F2'
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_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
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_audit_update_record
;
2016-01-04 deposited with the CCDC.
2016-01-19 downloaded from the CCDC.
;
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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^)+(0.0640P)^2^+15.9912P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_refine_ls_wR_factor_ref         0.1940
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_reflns_number_gt                2354
_reflns_number_total             2935
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c6ob00008h2.cif
_cod_data_source_block           l0752a
_cod_depositor_comments          'Adding full bibliography for 7154920.cif.'
_cod_original_cell_volume        1318.90(17)
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