Three new energetic complexes with N,N-bis(1H-tetrazole-5-yl)-amine as high energy density materials: syntheses, structures, characterization and effects on the thermal decomposition of RDX.
Yang, Qi; Song, Xiaxia; Zhang, Wendou; Hou, Lei; Gong, Qibing; Xie, Gang; Wei, Qing; Chen, Sanping; Gao, Shengli; Dalton transactions (Cambridge, England : 2003) 46 (2017) 2626–2634; doi:10.1039/c6dt04439e

data_7041813
_publ_section_title
;
 Three new energetic complexes with N,N-bis(1H-tetrazole-5-yl)-amine as
 high energy density materials: syntheses, structures, characterization
 and effects on the thermal decomposition of RDX.
;
_journal_issue                   8
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              2626
_journal_page_last               2634
_journal_paper_doi               10.1039/c6dt04439e
_journal_volume                  46
_journal_year                    2017
_chemical_formula_moiety         'C4 H12 Cu N18 O5 Pb, 2(H2 O)'
_chemical_formula_sum            'C4 H16 Cu N18 O7 Pb'
_chemical_formula_weight         699.08
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_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2017-01-20 deposited with the CCDC.
2017-01-23 downloaded from the CCDC.
;
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_cell_angle_gamma                100.585(3)
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_cell_volume                     961.3(3)
_computing_cell_refinement       'Bruker SAINT'
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_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.982
_diffrn_measured_fraction_theta_max 0.968
_diffrn_measurement_device_type  'Bruker SMART CCD area-detector'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_radiation_type           MoK\a
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0728P)^2^+1.7081P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_gt                3298
_reflns_number_total             3784
_reflns_threshold_expression     'I > 2\s(I)'
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_cod_depositor_comments
'Adding full bibliography for 7041813--7041814.cif.'
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