Bis(acridine-<i>N</i>)(nitrato-<i>O</i>,<i>O</i>')silver(I)
Sloufova, Ivana; Slouf, Miroslav; Acta Crystallographica Section C 56 (2000) 1312–1313; doi:10.1107/S0108270100011392

data_2011483
_publ_section_title
;
 Bis(acridine-<i>N</i>)(nitrato-<i>O</i>,<i>O</i>')silver(I)
;
_journal_issue                   11
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1312
_journal_page_last               1313
_journal_paper_doi               10.1107/S0108270100011392
_journal_volume                  56
_journal_year                    2000
_chemical_formula_iupac          '[Ag (N O3) (C13 H9 N)2]'
_chemical_formula_moiety         'C26 H18 Ag N3 O3'
_chemical_formula_sum            'C26 H18 Ag N3 O3'
_chemical_formula_weight         528.30
_chemical_name_common
;
Bis(acridine)(nitrato)silver
;
_chemical_name_systematic
;
Bis(acridine)(nitrato-O,O')silver(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'
_audit_creation_method           SHELXL97
_cell_angle_alpha                108.190(10)
_cell_angle_beta                 91.93(2)
_cell_angle_gamma                94.23(2)
_cell_formula_units_Z            2
_cell_length_a                   9.128(3)
_cell_length_b                   10.096(2)
_cell_length_c                   11.763(2)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      13
_cell_measurement_theta_min      12
_cell_volume                     1025.2(4)
_computing_cell_refinement       'CAD-4 Software'
_computing_data_collection       'CAD-4 Software (Enraf-Nonius, 1989)'
_computing_data_reduction        'JANA2000 (Petricek & Dusek, 2000)'
_computing_molecular_graphics    'PLATON (Spek, 1990)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      150.00(10)
_diffrn_measured_fraction_theta_full .999
_diffrn_measured_fraction_theta_max 1.00
_diffrn_measurement_device_type  'Enraf-Nonius CAD-4'
_diffrn_measurement_method       background-peak-background
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     .71069
_diffrn_reflns_av_R_equivalents  .000
_diffrn_reflns_av_sigmaI/netI    .0112
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -13
_diffrn_reflns_number            3593
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         24.98
_diffrn_reflns_theta_min         1.83
_diffrn_standards_decay_%        0
_diffrn_standards_interval_time  60
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    1.020
_exptl_absorpt_correction_T_max  .797
_exptl_absorpt_correction_T_min  .793
_exptl_absorpt_correction_type   spherical
_exptl_absorpt_process_details   '(JANA2000; Petricek & Dusek, 2000)'
_exptl_crystal_colour            'translucent intense brown'
_exptl_crystal_density_diffrn    1.711
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'prism with strongly rounded edges'
_exptl_crystal_F_000             532
_exptl_crystal_size_max          .20
_exptl_crystal_size_mid          .15
_exptl_crystal_size_min          .15
_refine_diff_density_max         .583
_refine_diff_density_min         -.717
_refine_ls_extinction_coef       .0035(7)
_refine_ls_extinction_method     'SHELXL97 (Sheldrick, 1997)'
_refine_ls_goodness_of_fit_ref   1.192
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     335
_refine_ls_number_reflns         3593
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.192
_refine_ls_R_factor_all          .021
_refine_ls_R_factor_gt           .020
_refine_ls_shift/su_max          .002
_refine_ls_shift/su_mean         .000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w = 1/[\s^2^(Fo^2^)+(0.0269P)^2^+0.7513P] where P = (Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         .056
_reflns_number_gt                3466
_reflns_number_total             3593
_reflns_threshold_expression     I>2sigma(I)
_cod_data_source_file            av1049.cif
_cod_data_source_block           I
_cod_database_code               2011483
_cod_database_fobs_code          2011483