Dinitromethyltetrazole (DNMT)-based energetic coordination polymers (ECPs) as lead-free primary explosives and laser initiators
Guo, Jinkun; Huang, Shiliang; Wei, Liyuan; Lang, Qing; Hao, Wenjia; Xu, Yuangang; Liu, Yu; Lu, Ming; New Journal of Chemistry 48 (2024) 18014–18021; doi:10.1039/D4NJ03134B

data_7063482
_publ_section_title
;
 Dinitromethyltetrazole (DNMT)-based energetic coordination polymers
 (ECPs) as lead-free primary explosives and laser initiators
;
_journal_issue                   41
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              18014
_journal_page_last               18021
_journal_paper_doi               10.1039/D4NJ03134B
_journal_volume                  48
_journal_year                    2024
_chemical_formula_moiety         'C2 N6 O4, 2(Rb)'
_chemical_formula_sum            'C2 N6 O4 Rb2'
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Olex2 1.5
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2024-09-20 deposited with the CCDC.	2024-09-25 downloaded from the CCDC.
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_diffrn_source                   'micro-focus sealed X-ray tube'
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CrysAlisPro 1.171.40.84a (Rigaku Oxford Diffraction, 2020)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
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_refine_ls_shift/su_max          0.001
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_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0406P)^2^+1.4954P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_Friedel_coverage         0.000
_reflns_number_gt                844
_reflns_number_total             882
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d4nj03134b2.cif
_cod_data_source_block           Rb2(DNMT)
_cod_depositor_comments
'Adding full bibliography for 7063480--7063485.cif.'
_cod_database_code               7063482
_shelx_shelxl_version_number     2017/1
_shelx_estimated_absorpt_t_max   0.524
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_olex2_refinement_description
;
;
_shelx_res_checksum              67249
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_olex2_submission_special_instructions 'No special instructions were received'