Poly[bis(μ~3~-acetato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>:<i>O</i>')bis(μ~2~-acetato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>)(μ~2~-2,5-dimethylbenzene-1,4-diol-κ^2^<i>O</i>:<i>O</i>')dilead(II)]
Lyczko, Krzysztof; Bak, Joanna; Acta Crystallographica Section E 64 (2008) m1341–m1342; doi:10.1107/S1600536808030535

data_2219664
_publ_section_title
Poly[bis(\m~3~-acetato-\k^4^<i>O</i>,<i>O</i>':<i>O</i>:<i>O</i>')bis(\m~2~-acetato-\k^3^<i>O</i>,<i>O</i>':<i>O</i>)(\m~2~-2,5-dimethylbenzene-1,4-diol-\k^2^<i>O</i>:<i>O</i>')dilead(II)]
_journal_coeditor_code           NC2114
_journal_issue                   10
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m1341
_journal_page_last               m1342
_journal_paper_doi               10.1107/S1600536808030535
_journal_volume                  64
_journal_year                    2008
_chemical_formula_iupac          '[Pb2 (C2 H3 O2)4 (C8 H10 O2)]'
_chemical_formula_moiety         'C16 H22 O10 Pb2'
_chemical_formula_sum            'C16 H22 O10 Pb2'
_chemical_formula_weight         788.72
_chemical_name_systematic
;
Poly[bis(\m~3~-acetato-\k^4^<i>O</i>,<i>O</i>':<i>O</i>:<i>O</i>')bis(\m~2~-
acetato-\k^3^<i>O</i>,<i>O</i>':<i>O</i>)(\m~2~-2,5-dimethylbenzene-1,4-
diol-\k^2^<i>O</i>:<i>O</i>')dilead(II)]
;
_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
_cell_angle_alpha                93.043(11)
_cell_angle_beta                 100.787(12)
_cell_angle_gamma                116.377(14)
_cell_formula_units_Z            1
_cell_length_a                   7.4905(11)
_cell_length_b                   7.5526(10)
_cell_length_c                   10.2522(15)
_cell_measurement_reflns_used    9065
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      28.6639
_cell_measurement_theta_min      3.0399
_cell_volume                     504.28(14)
_computing_cell_refinement       'CrysAlis RED (Oxford Diffraction, 2005)'
_computing_data_collection       'CrysAlis CCD (Oxford Diffraction, 2005)'
_computing_data_reduction        'CrysAlis RED (Oxford Diffraction, 2005)'
_computing_molecular_graphics    'Mercury (Macrae <i>et al.</i>,  2006)'
_computing_publication_material  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 8.6479
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.930
_diffrn_measurement_device_type  'Kuma KM-4 four-circle CCD'
_diffrn_measurement_method       \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  0.0410
_diffrn_reflns_av_sigmaI/netI    0.0284
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -13
_diffrn_reflns_number            9065
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         28.73
_diffrn_reflns_theta_min         3.05
_diffrn_standards_decay_%        0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    16.722
_exptl_absorpt_correction_T_max  0.226765
_exptl_absorpt_correction_T_min  0.03995
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_process_details   '(CrysAlis RED; Oxford Diffraction, 2005)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    2.597
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prismatic
_exptl_crystal_F_000             362
_exptl_crystal_size_max          0.35
_exptl_crystal_size_mid          0.26
_exptl_crystal_size_min          0.14
_refine_diff_density_max         1.297
_refine_diff_density_min         -1.669
_refine_ls_extinction_coef       0.0077(5)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method     'SHELXL97 (Sheldrick, 2008)'
_refine_ls_goodness_of_fit_ref   1.067
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     132
_refine_ls_number_reflns         2432
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.067
_refine_ls_R_factor_all          0.0184
_refine_ls_R_factor_gt           0.0173
_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^)+(0.0223P)^2^+0.6288P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0425
_refine_ls_wR_factor_ref         0.0428
_reflns_number_gt                2317
_reflns_number_total             2432
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            nc2114.cif
_cod_data_source_block           I
_cod_original_cell_volume        504.28(12)
_cod_database_code               2219664
_cod_database_fobs_code          2219664