Synthesis, structures and magnetic properties of the dimorphic Mn2CrSbO6 oxide.
Dos Santos-García, Antonio J; Solana-Madruga, Elena; Ritter, Clemens; Ávila-Brande, David; Fabelo, Oscar; Sáez-Puche, Regino; Dalton transactions (Cambridge, England : 2003) 44 (2015) 10665–10672; doi:10.1039/c4dt03849e

data_7033686
_publ_section_title
;
 Synthesis, structures and magnetic properties of the dimorphic Mn2CrSbO6
 oxide.
;
_journal_issue                   23
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              10665
_journal_page_last               10672
_journal_paper_doi               10.1039/c4dt03849e
_journal_volume                  44
_journal_year                    2015
_chemical_formula_moiety         Cr_Mn2_O6_Sb
_chemical_formula_structural     CrMn2O6Sb
_chemical_formula_sum            'Cr Mn2 O6 Sb'
_chemical_formula_weight         379.63
_chemical_name_systematic        ' ?'
_space_group_IT_number           148
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90.00000
_cell_angle_beta                 90.00000
_cell_angle_gamma                120.00000
_cell_formula_units_Z            1
_cell_length_a                   5.2084(4)
_cell_length_b                   5.2084(4)
_cell_length_c                   14.4000(11)
_cell_measurement_temperature    300
_cell_volume                     338.30(4)
_computing_structure_refinement  FULLPROF
_diffrn_ambient_temperature      300
_diffrn_measurement_device_type  PND_D2B
_diffrn_measurement_method       Vanadium
_diffrn_radiation_type           neutron
_diffrn_radiation_wavelength     1.59360
_diffrn_source                   'nuclear reactor'
_diffrn_source_type              D2B
_pd_instr_location               ' ?'
_pd_meas_2theta_range_inc        0.050018
_pd_meas_2theta_range_max        159.95000
_pd_meas_2theta_range_min        0.00000
_pd_meas_number_of_points        3200
_pd_proc_2theta_range_inc        0.050018
_pd_proc_2theta_range_max        160.0842
_pd_proc_2theta_range_min        0.1342
_pd_proc_ls_background_function  'Legendre polynomials'
_pd_proc_ls_pref_orient_corr     ' ?'
_pd_proc_ls_profile_function     'pseudo-Voigt function'
_pd_proc_ls_prof_R_factor        3.5078
_pd_proc_ls_prof_wR_expected     3.2375
_pd_proc_ls_prof_wR_factor       4.4588
_pd_proc_wavelength              1.593600
_pd_spec_mounting                ' ?'
_refine_ls_goodness_of_fit_all   1.3772
_refine_ls_number_parameters     20
_refine_ls_number_reflns         159
_refine_ls_number_restraints     0
_refine_ls_R_I_factor            3.7935
_cod_data_source_file            c4dt03849e1.cif
_cod_data_source_block           ilmenite
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Trigonal' changed to 'trigonal'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2935 2014-11-11 08:27:57Z andrius 

 Adding full bibliography for 7033685--7033686.cif.
;
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        CrMn2O6Sb
_cod_database_code               7033686
_pd_proc_ls_prof_cr_factor       18.4174
_pd_proc_ls_prof_cwr_factor      16.7398
_pd_proc_ls_prof_cwr_expected    12.1548