<i>catena</i>-Poly[[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(pyridine-3-carboxylato-κ^2^<i>O</i>:<i>O</i>')cadmium(II)]-μ-pyridine-3-carboxylato-κ^3^<i>N</i>:<i>O</i>,<i>O</i>']
Hong-Chao Yi; Ping Mei; Acta Crystallographica Section E 63 (2007) m1920–m1920; doi:10.1107/S1600536807027936

data_2214157
_publ_section_title
<i>catena</i>-Poly[[(1,10-phenanthroline-\k^2^<i>N</i>,<i>N</i>')(pyridine-3-carboxylato-\k^2^<i>O</i>:<i>O</i>')cadmium(II)]-\m-pyridine-3-carboxylato-\k^3^<i>N</i>:<i>O</i>,<i>O</i>']
_journal_coeditor_code           DN2189
_journal_issue                   7
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m1920
_journal_page_last               m1920
_journal_paper_doi               10.1107/S1600536807027936
_journal_volume                  63
_journal_year                    2007
_chemical_formula_iupac          '[Cd (C6 H4 N O2)2 (C12 H8 N2)]'
_chemical_formula_moiety         'C24 H16 Cd N4 O4'
_chemical_formula_sum            'C24 H16 Cd N4 O4'
_chemical_formula_weight         536.81
_chemical_name_systematic
;
catena-Poly[[(1,10-phenanthroline-\k^2^N,N')(pyridine-3-carboxylato-\
\k^2^O:O')cadmium(II)]-\m-pyridine-3-carboxylato-\k^3^N:O,O']
;
_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                77.7050(10)
_cell_angle_beta                 84.0940(10)
_cell_angle_gamma                69.9840(10)
_cell_formula_units_Z            2
_cell_length_a                   7.9274(5)
_cell_length_b                   10.8456(7)
_cell_length_c                   13.3381(9)
_cell_measurement_reflns_used    5362
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      29.46
_cell_measurement_theta_min      2.32
_cell_volume                     1052.23(12)
_computing_cell_refinement       'SAINT (Bruker, 1997)'
_computing_data_collection       'SMART (Bruker, 1997)'
_computing_data_reduction        SAINT
_computing_molecular_graphics
;
ORTEPIII (Burnett & Johnson, 1996) and ORTEP-3 for Windows (Farrugia,
1997)
;
_computing_publication_material  SHELXL97
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.970
_diffrn_measured_fraction_theta_max 0.970
_diffrn_measurement_device_type  'Bruker SMART CCD area-detector'
_diffrn_measurement_method       '\f and \w'
_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  0.0145
_diffrn_reflns_av_sigmaI/netI    0.0240
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            6811
_diffrn_reflns_theta_full        27.49
_diffrn_reflns_theta_max         27.49
_diffrn_reflns_theta_min         2.32
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.079
_exptl_absorpt_correction_T_max  0.8815
_exptl_absorpt_correction_T_min  0.6661
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Bruker, 2000)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.694
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             536
_exptl_crystal_size_max          0.41
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.12
_refine_diff_density_max         0.542
_refine_diff_density_min         -0.507
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.069
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     298
_refine_ls_number_reflns         4681
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.069
_refine_ls_R_factor_all          0.0238
_refine_ls_R_factor_gt           0.0225
_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^)+(0.0261P)^2^+0.3996P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0569
_refine_ls_wR_factor_ref         0.0576
_reflns_number_gt                4465
_reflns_number_total             4681
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            dn2189.cif
_cod_data_source_block           I
_cod_database_code               2214157
_cod_database_fobs_code          2214157