Change of electrical conductivities between hydrated and dehydrated samples of honeycomb sheet structures with mixed oxidation state paddlewheel dirhodium complexes and halide ions.
Fuma, Yasuhiro; Miyashita, Osamu; Kawamura, Takashi; Ebihara, Masahiro; Dalton transactions (Cambridge, England : 2003) 41 (2012) 8242–8251; doi:10.1039/c2dt11609j

data_7019203
_publ_section_title
;
 Change of electrical conductivities between hydrated and dehydrated
 samples of honeycomb sheet structures with mixed oxidation state
 paddlewheel dirhodium complexes and halide ions.
;
_journal_issue                   27
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              8242
_journal_page_last               8251
_journal_paper_doi               10.1039/c2dt11609j
_journal_volume                  41
_journal_year                    2012
_chemical_formula_moiety         'C36 H72 Br2 N12 O12 Rh6, 6(H2 O)'
_chemical_formula_sum            'C36 H84 Br2 N12 O18 Rh6'
_chemical_formula_weight         1750.44
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_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                117.150(10)
_cell_angle_beta                 93.74(2)
_cell_angle_gamma                113.690(10)
_cell_formula_units_Z            1
_cell_length_a                   11.446(3)
_cell_length_b                   12.754(4)
_cell_length_c                   13.172(4)
_cell_measurement_reflns_used    4272
_cell_measurement_temperature    123(2)
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.1
_cell_volume                     1492.1(8)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      123(2)
_diffrn_detector_area_resol_mean 14.62
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'Rigaku/MSC Mercury CCD'
_diffrn_measurement_method       \w
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0383
_diffrn_reflns_av_sigmaI/netI    0.0597
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            12344
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         3.05
_diffrn_source                   'rotating-anode X-ray tube'
_exptl_absorpt_coefficient_mu    3.031
_exptl_absorpt_correction_T_max  0.906
_exptl_absorpt_correction_T_min  0.638
_exptl_absorpt_correction_type   integration
_exptl_absorpt_process_details   '(Higashi, 1999)'
_exptl_crystal_colour            Brown
_exptl_crystal_density_diffrn    1.948
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Platelet
_exptl_crystal_F_000             868
_exptl_crystal_size_max          0.10
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.03
_refine_diff_density_max         1.263
_refine_diff_density_min         -0.873
_refine_diff_density_rms         0.161
_refine_ls_extinction_coef       0.00094(18)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.139
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     362
_refine_ls_number_reflns         6793
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.139
_refine_ls_R_factor_all          0.0688
_refine_ls_R_factor_gt           0.0505
_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^)+(0.0089P)^2^+5.4497P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0730
_refine_ls_wR_factor_ref         0.0773
_reflns_number_gt                5815
_reflns_number_total             6793
_reflns_threshold_expression     ' I>2\s(I)'
_cod_data_source_file            c2dt11609j.txt
_cod_data_source_block           '[{Rh2(pram)4}3Br2].6H2O_(5.6H2O)'
_cod_original_sg_symbol_H-M      'P -1 '
_cod_database_code               7019203