<i>catena</i>-Poly[[(18-crown-6-κ^6^<i>O</i>)potassium]-μ-chlorido-[(1<i>H</i>-benzotriazol-1-ol-κ<i>N</i>^3^)chloridoplatinum(II)]-μ-(benzotriazol-1-olato-κ^2^<i>N</i>^3^:<i>O</i>)]
Ravindran Durai Nayagam, B.; Jebas, Samuel Robinson; Shakina, J.; Murugesan, R.; Schollmeyer, Dieter; Acta Crystallographica Section E 66 (2010) m631–; doi:10.1107/S1600536810015898

data_2226052
_publ_section_title
;
 <i>catena</i>-Poly[[(18-crown-6-\k^6^<i>O</i>)potassium]-\m-chlorido-[(1<i>H</i>-benzotriazol-1-ol-\k<i>N</i>^3^)chloridoplatinum(II)]-\m-(benzotriazol-1-olato-\k^2^<i>N</i>^3^:<i>O</i>)]
;
_journal_coeditor_code           BT5255
_journal_issue                   6
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m631
_journal_paper_doi               10.1107/S1600536810015898
_journal_volume                  66
_journal_year                    2010
_chemical_formula_iupac
'[K Pt (C6 H4 N3 O) Cl2 (C6 H5 N3 O) (C12 H24 O6)]'
_chemical_formula_moiety         'C24 H33 Cl2 K N6 O8 Pt'
_chemical_formula_sum            'C24 H33 Cl2 K N6 O8 Pt'
_chemical_formula_weight         838.65
_chemical_name_systematic
<i>catena</i>-Poly[[(18-crown-6-\k^6^<i>O</i>)potassium]-\m-chlorido-[(1<i>H</i>-benzotriazol-1-ol-\k<i>N</i>^3^)chloridoplatinum(II)]-\m-(benzotriazol-1-olato-\k^2^<i>N</i>^3^:<i>O</i>)]
_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           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 99.249(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   14.2727(13)
_cell_length_b                   10.9821(10)
_cell_length_c                   20.0716(18)
_cell_measurement_reflns_used    8964
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      26.9
_cell_measurement_theta_min      2.3
_cell_volume                     3105.2(5)
_computing_cell_refinement       'SAINT-Plus (Bruker, 2008)'
_computing_data_collection       'APEX2 (Bruker, 2008)'
_computing_data_reduction        'SAINT-Plus (Bruker, 2008)'
_computing_molecular_graphics    'SHELXTL (Sheldrick, 2008)'
_computing_publication_material
;
SHELXTL (Sheldrick, 2008) and PLATON (Spek, 2009)
;
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.982
_diffrn_measured_fraction_theta_max 0.982
_diffrn_measurement_device       '\k-geometry diffractometer'
_diffrn_measurement_device_type  'Bruker SMART CCD'
_diffrn_measurement_method       'CCD scan'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0000
_diffrn_reflns_av_sigmaI/netI    0.0805
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            10775
_diffrn_reflns_theta_full        28.04
_diffrn_reflns_theta_max         28.04
_diffrn_reflns_theta_min         1.45
_exptl_absorpt_coefficient_mu    4.880
_exptl_absorpt_correction_T_max  0.746
_exptl_absorpt_correction_T_min  0.494
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(TWINABS; Sheldrick, 1999)'
_exptl_crystal_colour            'light yellow'
_exptl_crystal_density_diffrn    1.794
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1656
_exptl_crystal_size_max          0.17
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.08
_refine_diff_density_max         1.772
_refine_diff_density_min         -1.784
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.073
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     382
_refine_ls_number_reflns         10775
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.073
_refine_ls_R_factor_all          0.0825
_refine_ls_R_factor_gt           0.0633
_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^)+(0.0972P)^2^+18.2058P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_obs         0.1663
_refine_ls_wR_factor_ref         0.1781
_reflns_number_gt                9006
_reflns_number_total             10775
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            bt5255.cif
_cod_data_source_block           I
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               2226052
_cod_database_fobs_code          2226052