(2,9-Dimethoxy-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nitratosilver(I)
Wan, Xin-Sheng; Zhang, Hai-Yan; Niu, Cao-Yuan; Kou, Chun-Hong; Feng, Cao-Ling; Acta Crystallographica Section E 63 (2007) m2951–m2951; doi:10.1107/S1600536807055146

data_2216249
_publ_section_title
;
 (2,9-Dimethoxy-1,10-phenanthroline-\k^2^<i>N</i>,<i>N</i>')nitratosilver(I)
;
_journal_coeditor_code           BH2139
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m2951
_journal_page_last               m2951
_journal_paper_doi               10.1107/S1600536807055146
_journal_volume                  63
_journal_year                    2007
_chemical_formula_iupac          '[Ag (N O3) (C14 H12 N2 O2)]'
_chemical_formula_moiety         'C14 H12 Ag N3 O5'
_chemical_formula_sum            'C14 H12 Ag N3 O5'
_chemical_formula_weight         410.14
_chemical_name_systematic
;
(2,9-Dimethoxy-1,10-phenanthroline-\k^2^<i>N</i>,<i>N</i>')nitratosilver(I)
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL97
_cell_angle_alpha                105.174(3)
_cell_angle_beta                 92.224(3)
_cell_angle_gamma                92.896(3)
_cell_formula_units_Z            2
_cell_length_a                   6.8510(12)
_cell_length_b                   10.3094(17)
_cell_length_c                   10.7294(18)
_cell_measurement_reflns_used    1736
_cell_measurement_temperature    291(2)
_cell_measurement_theta_max      25.49
_cell_measurement_theta_min      2.98
_cell_volume                     729.4(2)
_computing_cell_refinement       'SMART (Bruker, 2001)'
_computing_data_collection       'SMART (Bruker, 2001)'
_computing_data_reduction        'SAINT (Bruker, 2001)'
_computing_molecular_graphics    'SHELXTL (Bruker, 2001)'
_computing_publication_material  'SHELXTL (Bruker, 2001)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      291(2)
_diffrn_measured_fraction_theta_full 0.980
_diffrn_measured_fraction_theta_max 0.980
_diffrn_measurement_device_type  'Bruker APEX-II CCD 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  0.0153
_diffrn_reflns_av_sigmaI/netI    0.0298
_diffrn_reflns_limit_h_max       7
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -9
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            3810
_diffrn_reflns_theta_full        25.49
_diffrn_reflns_theta_max         25.49
_diffrn_reflns_theta_min         2.98
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.412
_exptl_absorpt_correction_T_max  0.8602
_exptl_absorpt_correction_T_min  0.5387
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Bruker, 2001)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.867
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             408
_exptl_crystal_size_max          0.50
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.11
_refine_diff_density_max         1.513
_refine_diff_density_min         -0.648
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.071
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     210
_refine_ls_number_reflns         2659
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.071
_refine_ls_R_factor_all          0.0506
_refine_ls_R_factor_gt           0.0433
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0759P)^2^+0.3168P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1146
_refine_ls_wR_factor_ref         0.1221
_reflns_number_gt                2271
_reflns_number_total             2659
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            bh2139.cif
_cod_data_source_block           I
_cod_database_code               2216249
_cod_database_fobs_code          2216249