Os(II) Phosphors with Near-Infrared Emission Induced by Ligand-to-Ligand Charge Transfer Transition.
Liao, Jia-Ling; Chi, Yun; Liu, Shih-Hung; Lee, Gene-Hsiang; Chou, Pi-Tai; Huang, Hao-Xiang; Su, Yu-De; Chang, Chih-Hao; Lin, Jin-Sheng; Tseng, Meu-Rurng; Inorganic chemistry 53 (2014) 9366–9374; doi:10.1021/ic501474r

data_4340881
_publ_section_title
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 Os(II) Phosphors with Near-Infrared Emission Induced by Ligand-to-Ligand
 Charge Transfer Transition.
;
_journal_issue                   17
_journal_name_full               'Inorganic chemistry'
_journal_page_first              9366
_journal_page_last               9374
_journal_paper_doi               10.1021/ic501474r
_journal_volume                  53
_journal_year                    2014
_chemical_formula_sum            'C32 H30 F6 N8 Os P2'
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_computing_cell_refinement       'Bruker SAINT'
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_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.999
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_diffrn_measurement_device_type  'BRUKER SMART APEXCCD area detector'
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_diffrn_radiation_monochromator  graphite
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_diffrn_reflns_theta_min         1.17
_exptl_absorpt_coefficient_mu    3.923
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_exptl_crystal_colour            dark-green
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0252P)^2^+6.1414P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0765
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_reflns_number_gt                12616
_reflns_number_total             15565
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic501474r_si_001.cif
_cod_data_source_block           3
_cod_depositor_comments
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The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/home/saulius/struct/COD-crude-data--automatic-downloads/rss-feeds/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 

 Adding full bibliography for 4340879--4340881.cif.

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not_measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
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_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               4340881