Ordnung muss sein: heteroelement order and disorder in polyoxovanadates.
Wendt, M.; Mahnke, L. K.; Näther, C; van Leusen, J.; Kögerler, P; Bensch, W.; Dalton transactions (Cambridge, England : 2003) 47 (2018) 6672–6674; doi:10.1039/c8dt00715b

data_7045984
_publ_section_title
;
 Ordnung muss sein: heteroelement order and disorder in polyoxovanadates.
;
_journal_issue                   19
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'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              6672
_journal_page_last               6674
_journal_paper_doi               10.1039/c8dt00715b
_journal_volume                  47
_journal_year                    2018
_chemical_formula_sum            'C18 H75 Ge3 N18 Ni3 O45 Sb3 V15'
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;
2018-03-16 deposited with the CCDC.
2018-04-09 downloaded from the CCDC.
;
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;
XP in SHELXTL (Sheldrick, 2008) and Diamond (Brandenburg, 1999)
;
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;
 Flack x determined using 4336 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   0.017(8)
_refine_ls_extinction_coef       0.00207(10)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method     SHELXL
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_refine_ls_R_factor_all          0.0375
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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^)+(0.0480P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_Friedel_coverage         0.930
_reflns_Friedel_fraction_full    0.978
_reflns_Friedel_fraction_max     0.967
_reflns_number_gt                10007
_reflns_number_total             11322
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_cod_data_source_block           Compound2
_cod_depositor_comments
'Adding full bibliography for 7045984--7045986.cif.'
_cod_original_cell_volume        4794.3(6)
_cod_database_code               7045984
_shelxl_version_number           2014-3
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