Bis(2,2'-bipyridine)-1κ^2^<i>N</i>,<i>N</i>';3κ^2^<i>N</i>,<i>N</i>'-hexa-μ-methacrylato-1:2κ^6^<i>O</i>:<i>O</i>';2:3κ^6^<i>O</i>:<i>O</i>'-(nitrato-2κ^2^<i>O</i>,<i>O</i>')-1,3-dicobalt(II)-2-terbium(III)
Wu, Bin; Zhao, Cheng-Xin; Acta Crystallographica Section E 66 (2010) m1075–; doi:10.1107/S1600536810031053

data_2228101
_publ_section_title
;
 Bis(2,2'-bipyridine)-1\k^2^<i>N</i>,<i>N</i>';3\k^2^<i>N</i>,<i>N</i>'-hexa-\m-methacrylato-1:2\k^6^<i>O</i>:<i>O</i>';2:3\k^6^<i>O</i>:<i>O</i>'-(nitrato-2\k^2^<i>O</i>,<i>O</i>')-1,3-dicobalt(II)-2-terbium(III)
;
_journal_coeditor_code           XU5010
_journal_issue                   9
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m1075
_journal_paper_doi               10.1107/S1600536810031053
_journal_volume                  66
_journal_year                    2010
_chemical_formula_iupac          '[Co2 Tb (C4 H5 O2)6 (N O3) (C10 H8 N2)2]'
_chemical_formula_moiety         'C44 H46 Co2 N5 O15 Tb'
_chemical_formula_sum            'C44 H46 Co2 N5 O15 Tb'
_chemical_formula_weight         1161.64
_chemical_name_systematic
;
Bis(2,2'-bipyridine)-1\k^2^<i>N</i>,<i>N</i>';3\k^2^<i>N</i>,<i>N</i>'-hexa-
\m-methacrylato-1:2\k^6^<i>O</i>:<i>O</i>';2:3\k^6^<i>O</i>:<i>O</i>'-
(nitrato-2\k^2^<i>O</i>,<i>O</i>')-1,3-dicobalt(II)-2-terbium(III)
;
_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           SHELXL-97
_cell_angle_alpha                103.912(2)
_cell_angle_beta                 99.950(2)
_cell_angle_gamma                99.845(3)
_cell_formula_units_Z            2
_cell_length_a                   11.3717(6)
_cell_length_b                   13.4396(5)
_cell_length_c                   16.3572(8)
_cell_measurement_reflns_used    10681
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.46
_cell_measurement_theta_min      2.02
_cell_volume                     2330.26(19)
_computing_cell_refinement       'RAPID-AUTO (Rigaku, 1998)'
_computing_data_collection       'RAPID-AUTO (Rigaku, 1998)'
_computing_data_reduction        'CrystalStructure (Rigaku/MSC, 2002)'
_computing_molecular_graphics    'ORTEP-3 (Farrugia, 1997)'
_computing_publication_material
'SHELXL97 (Sheldrick, 2008) and PLATON (Spek, 2009)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 10.00
_diffrn_measured_fraction_theta_full 0.970
_diffrn_measured_fraction_theta_max 0.970
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       \w
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0305
_diffrn_reflns_av_sigmaI/netI    0.0304
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            13172
_diffrn_reflns_theta_full        25.10
_diffrn_reflns_theta_max         25.10
_diffrn_reflns_theta_min         1.32
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    2.278
_exptl_absorpt_correction_T_max  0.709
_exptl_absorpt_correction_T_min  0.495
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(ABSCOR; Higashi, 1995)'
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    1.656
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1168
_exptl_crystal_size_max          0.32
_exptl_crystal_size_mid          0.31
_exptl_crystal_size_min          0.15
_refine_diff_density_max         0.445
_refine_diff_density_min         -0.866
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.030
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     610
_refine_ls_number_reflns         8051
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.030
_refine_ls_R_factor_all          0.0301
_refine_ls_R_factor_gt           0.0246
_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^)+(0.0316P)^2^+2.6217P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0580
_refine_ls_wR_factor_ref         0.0604
_reflns_number_gt                7272
_reflns_number_total             8051
_reflns_threshold_expression     I>2sigma(I)
_cod_data_source_file            xu5010.cif
_cod_data_source_block           I
_cod_database_code               2228101
_cod_database_fobs_code          2228101