Nonparallel Stacks of Donor and Acceptor Chromophores Evade Geminate Charge Recombination.
Mallia, Ajith R.; Salini, P. S.; Hariharan, Mahesh; Journal of the American Chemical Society 137 (2015) 15604–15607; doi:10.1021/jacs.5b08257

data_4129567
_publ_section_title
;
 Nonparallel Stacks of Donor and Acceptor Chromophores Evade Geminate
 Charge Recombination.
;
_journal_issue                   50
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              15604
_journal_page_last               15607
_journal_paper_doi               10.1021/jacs.5b08257
_journal_volume                  137
_journal_year                    2015
_chemical_formula_moiety         'C25 H19 N O3'
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_cell_measurement_theta_max      30.11
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_diffrn_ambient_temperature      296(2)
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_diffrn_measurement_device_type  'Bruker APEX-II CCD'
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_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.1423P)^2^+1.3327P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_threshold_expression     >2\s(I)
_cod_data_source_file            ja5b08257_si_003.cif
_cod_data_source_block           final2
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_symmetry_cell_setting' value 'Triclinic' was changed to
'triclinic' in accordance with the
/home/saulius/struct/COD-crude-data/automatic-downloads/DataCite-retrospective/ACS/depositions/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 6909 2019-04-08 15:41:33Z antanas 
;
_cod_original_sg_symbol_Hall     ' -P 1'
_cod_original_sg_symbol_H-M      'P-1   '
_cod_database_code               4129567