Infection microenvironment-responsive composites based on a Ag(I) complex for targeted antimicrobial treatment.
Han, Jing; Hou, Yue; Yu, Zhong; Chen, Yi-Xuan; Xue, Jian-Fei; Zhang, Yue-Juan; Gao, Lei; Wan, Yi; Dalton transactions (Cambridge, England : 2003) 55 (2026) 3323–3335; doi:10.1039/d5dt02724a

data_7720136
_publ_section_title
;
 Infection microenvironment-responsive composites based on a Ag(I) complex
 for targeted antimicrobial treatment.
;
_journal_issue                   8
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              3323
_journal_page_last               3335
_journal_paper_doi               10.1039/d5dt02724a
_journal_volume                  55
_journal_year                    2026
_chemical_formula_sum            'C34 H35 Ag6 F9 N2 O6'
_chemical_formula_weight         1385.86
_space_group_crystal_system      orthorhombic
_space_group_IT_number           61
_space_group_name_Hall           '-P 2ac 2ab'
_space_group_name_H-M_alt        'P b c a'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2024-12-12 deposited with the CCDC.	2026-01-23 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   17.68875(19)
_cell_length_b                   17.4738(2)
_cell_length_c                   26.8601(3)
_cell_measurement_reflns_used    10007
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      73.8130
_cell_measurement_theta_min      4.1160
_cell_volume                     8302.18(16)
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  angilent
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_reflns_av_R_equivalents  0.0617
_diffrn_reflns_av_unetI/netI     0.0584
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -7
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            16455
_diffrn_reflns_point_group_measured_fraction_full 0.995
_diffrn_reflns_point_group_measured_fraction_max 0.995
_diffrn_reflns_theta_full        66.002
_diffrn_reflns_theta_max         66.002
_diffrn_reflns_theta_min         3.918
_exptl_absorpt_coefficient_mu    23.023
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    2.218
_exptl_crystal_description       block
_exptl_crystal_F_000             5312
_exptl_crystal_size_max          0.180
_exptl_crystal_size_mid          0.170
_exptl_crystal_size_min          0.150
_refine_diff_density_max         4.654
_refine_diff_density_min         -4.167
_refine_diff_density_rms         0.558
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.192
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     550
_refine_ls_number_reflns         7203
_refine_ls_number_restraints     226
_refine_ls_restrained_S_all      1.218
_refine_ls_R_factor_all          0.1167
_refine_ls_R_factor_gt           0.1115
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0001P)^2^+1085.2308P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2448
_refine_ls_wR_factor_ref         0.2473
_reflns_Friedel_coverage         0.000
_reflns_number_gt                6543
_reflns_number_total             7203
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d5dt02724a2.cif
_cod_data_source_block           99
_cod_depositor_comments          'Adding full bibliography for 7720136.cif.'
_cod_original_cell_volume        8302.20(16)
_cod_database_code               7720136
_shelx_shelxl_version_number     2014/7
_shelx_estimated_absorpt_t_min   0.104
_shelx_estimated_absorpt_t_max   0.130
_shelx_res_checksum              89395
_shelx_hkl_checksum              23201