Crystal structure of <i>catena</i>-poly[[silver(I)-<i>{μ</i>}-<i>N</i>-(pyridin-2-ylmethyl)pyridine-3-amine-κ^2^<i>N</i>:<i>N</i>'] trifluoromethanesulfonate]
Moon, Suk-Hee; Cho, Seonghwa; Park, Ki-Min; Acta Crystallographica Section E 70 (2014) 389–391; doi:10.1107/S1600536814022922

data_2240105
_publ_section_title
;
 Crystal structure of
 <i>catena</i>-poly[[silver(I)-<i>{\m</i>}-<i>N</i>-(pyridin-2-ylmethyl)pyridine-3-amine-\k^2^<i>N</i>:<i>N</i>']
 trifluoromethanesulfonate]
;
_journal_issue                   11
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              389
_journal_page_last               391
_journal_paper_doi               10.1107/S1600536814022922
_journal_volume                  70
_journal_year                    2014
_chemical_formula_iupac          '[Ag (C11 H11 N3)] , C F3 S O3'
_chemical_formula_moiety         'C11 H11 Ag N3, C F3 O3 S'
_chemical_formula_sum            'C12 H11 Ag F3 N3 O3 S'
_chemical_formula_weight         442.17
_chemical_name_systematic
;
<i>catena</i>-Poly[[silver(I)-<i>\m</i>-<i>N</i>-(pyridin-2-ylmethyl)\
pyridine-3-amine-\k^2^<i>N</i>:<i>N</i>'] trifluoromethanesulfonate]
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXTL
_cell_angle_alpha                90.00
_cell_angle_beta                 99.8260(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   13.7529(6)
_cell_length_b                   10.8437(5)
_cell_length_c                   19.5795(9)
_cell_measurement_reflns_used    5639
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      28.15
_cell_measurement_theta_min      2.37
_cell_volume                     2877.1(2)
_computing_cell_refinement
;
<i>SAINT-Plus</i>  (Bruker, 2000)
;
_computing_data_collection
;
<i>SMART</i>   (Bruker, 2000)
;
_computing_data_reduction
;
<i>SAINT-Plus</i> (Bruker, 2000)
;
_computing_molecular_graphics
;
<i>DIAMOND</i> (Brandenburg, 2005)
;
_computing_publication_material
;
<i>SHELXTL</i> (Sheldrick, 2008)
;
_computing_structure_refinement
;
<i>SHELXL97</i> (Sheldrick, 2008)
;
_computing_structure_solution
;
<i>SHELXS97</i> (Sheldrick, 2008)
;
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Bruker SMART CCD area detector'
_diffrn_measurement_method       '\f and \w 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  0.0381
_diffrn_reflns_av_sigmaI/netI    0.0476
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       9
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            15852
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         1.50
_exptl_absorpt_coefficient_mu    1.598
_exptl_absorpt_correction_T_max  0.8565
_exptl_absorpt_correction_T_min  0.6371
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
(<i>SADABS</i>; Bruker, 2000)
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    2.042
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             1744
_exptl_crystal_size_max          0.31
_exptl_crystal_size_mid          0.22
_exptl_crystal_size_min          0.10
_refine_diff_density_max         1.037
_refine_diff_density_min         -0.672
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.060
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     415
_refine_ls_number_reflns         5629
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.060
_refine_ls_R_factor_all          0.0620
_refine_ls_R_factor_gt           0.0390
_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^)+(0.0369P)^2^+6.3774P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0823
_refine_ls_wR_factor_ref         0.0931
_reflns_number_gt                4286
_reflns_number_total             5629
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            zs2318sup1.cf
_cod_data_source_block           I
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               2240105
_cod_database_fobs_code          2240105