N-Oxides light up energetic performances: synthesis and characterization of dinitraminobisfuroxans and their salts
He, Chunlin; Tang, Yongxing; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M.; Journal of Materials Chemistry A 4 (2016) 8969–; doi:10.1039/C6TA03619H

data_7236329
_publ_section_title
;
 N-Oxides light up energetic performances: synthesis and characterization
 of dinitraminobisfuroxans and their salts
;
_journal_issue                   23
_journal_name_full               'Journal of Materials Chemistry A'
_journal_page_first              8969
_journal_paper_doi               10.1039/C6TA03619H
_journal_volume                  4
_journal_year                    2016
_chemical_formula_moiety         'C4 H2 N8 O8'
_chemical_formula_sum            'C4 H2 N8 O8'
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Olex2 1.2
(compiled 2015.01.26 svn.r3150 for OlexSys, GUI svn.r4998)
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2015-12-03 deposited with the CCDC.
2016-05-18 downloaded from the CCDC.
;
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_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device       'Fixed Chi Three-Circle Diffractometer'
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;
SADABS-2014/4 (Bruker,2014/4) was used for absorption correction.
wR2(int) was 0.0573 before and 0.0542 after correction.
The Ratio of minimum to maximum transmission is 0.9583.
The \l/2 correction factor is 0.00150.
;
_exptl_crystal_colour            colourless
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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^)+(0.0342P)^2^+0.4615P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0692
_refine_ls_wR_factor_ref         0.0743
_reflns_Friedel_coverage         0.000
_reflns_number_gt                2052
_reflns_number_total             2453
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c6ta03619h2.cif
_cod_data_source_block           shr27
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_diffrn_radiation_probe' value 'X-ray' was changed to
'x-ray' in accordance with the
/home/saulius/struct/COD-crude-data/automatic-downloads/DataCite-retrospective/RSC/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 
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_cod_database_code               7236329
_olex2_refinement_description
;
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_shelx_res_checksum              49145
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_olex2_submission_special_instructions 'No special instructions were received'