Syntheses, Structures, and Antimicrobial Activities of Remarkably Light-Stable and Water-Soluble Silver Complexes with Amino Acid Derivatives, Silver(I) N-Acetylmethioninates
Noriko Chikaraishi Kasuga; Rie Yoshikawa; Yoshitaka Sakai; Kenji Nomiya; Inorganic Chemistry 51 (2012) 1640–1647; doi:10.1021/ic201950p

data_4328181
_publ_section_title
;
 Syntheses, Structures, and Antimicrobial Activities of Remarkably
 Light-Stable and Water-Soluble Silver Complexes with Amino Acid
 Derivatives, Silver(I) N-Acetylmethioninates
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1640
_journal_page_last               1647
_journal_paper_doi               10.1021/ic201950p
_journal_volume                  51
_journal_year                    2012
_chemical_absolute_configuration
;
;
_chemical_compound_source        'local laboratory'
_chemical_formula_moiety         'C4 H8 Ag N O2 S'
_chemical_formula_sum            'C4 H8 Ag N O2 S'
_chemical_formula_weight         242.04
_chemical_name_systematic        ?
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   5.0463(4)
_cell_length_b                   5.6304(5)
_cell_length_c                   23.2902(19)
_cell_measurement_reflns_used    4542
_cell_measurement_temperature    90
_cell_measurement_theta_max      28.26
_cell_measurement_theta_min      3.50
_cell_volume                     661.74(10)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      90
_diffrn_detector_area_resol_mean 8.366
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0235
_diffrn_reflns_av_sigmaI/netI    0.0221
_diffrn_reflns_limit_h_max       5
_diffrn_reflns_limit_h_min       -6
_diffrn_reflns_limit_k_max       7
_diffrn_reflns_limit_k_min       -6
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            4923
_diffrn_reflns_theta_full        28.26
_diffrn_reflns_theta_max         28.26
_diffrn_reflns_theta_min         1.75
_exptl_absorpt_coefficient_mu    3.281
_exptl_absorpt_correction_T_max  0.8275
_exptl_absorpt_correction_T_min  0.4943
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'XPREP Bruker AXS 2000'
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    2.430
_exptl_crystal_description       granular
_exptl_crystal_F_000             472
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.06
_refine_diff_density_max         0.724
_refine_diff_density_min         -0.473
_refine_diff_density_rms         0.102
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.03(4)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.227
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_parameters     83
_refine_ls_number_reflns         1641
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.227
_refine_ls_R_factor_all          0.0192
_refine_ls_R_factor_gt           0.0190
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0082P)^2^+0.9600P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0446
_refine_ls_wR_factor_ref         0.0447
_reflns_number_gt                1638
_reflns_number_total             1641
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            ic201950p_si_001_3.cif
_cod_data_source_block           ryo0161
_cod_original_sg_symbol_H-M      'P21 21 21'
_cod_database_code               4328181