Diverse silver(i) sulfobenzoate coordination polymers and their recycling property as homogeneous catalyst in oxygenation of sulfide
Ma, Ai-Qing; Zhu, Long-Guan; RSC Adv. 4 (2014) 14691–; doi:10.1039/C3RA47136E

data_7235298
_publ_section_title
;
 Diverse silver(i) sulfobenzoate coordination polymers and their recycling
 property as homogeneous catalyst in oxygenation of sulfide
;
_journal_issue                   28
_journal_name_full               'RSC Adv.'
_journal_page_first              14691
_journal_paper_doi               10.1039/C3RA47136E
_journal_volume                  4
_journal_year                    2014
_chemical_formula_sum            'C98 H84 Ag6 N20 O21 S4'
_chemical_formula_weight         2653.31
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                84.345(3)
_cell_angle_beta                 75.994(3)
_cell_angle_gamma                76.864(3)
_cell_formula_units_Z            1
_cell_length_a                   10.6768(4)
_cell_length_b                   12.6832(4)
_cell_length_c                   19.6770(9)
_cell_measurement_temperature    295(2)
_cell_volume                     2515.04(17)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      295(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_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  0.0206
_diffrn_reflns_av_sigmaI/netI    0.0373
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            15742
_diffrn_reflns_theta_full        25.10
_diffrn_reflns_theta_max         25.10
_diffrn_reflns_theta_min         3.20
_exptl_absorpt_coefficient_mu    1.310
_exptl_absorpt_correction_T_max  0.7615
_exptl_absorpt_correction_T_min  0.7026
_exptl_crystal_density_diffrn    1.752
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1326
_exptl_crystal_size_max          0.29
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.22
_refine_diff_density_max         0.929
_refine_diff_density_min         -0.664
_refine_diff_density_rms         0.072
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.021
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     695
_refine_ls_number_reflns         8940
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.022
_refine_ls_R_factor_all          0.0585
_refine_ls_R_factor_gt           0.0408
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0432P)^2^+2.9219P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0933
_refine_ls_wR_factor_ref         0.1034
_reflns_number_gt                6935
_reflns_number_total             8940
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3ra47136e2.cif
_cod_data_source_block           120328_12_3_22_1
_cod_database_code               7235298