Cadmium and manganese hypophosphite perovskites templated by formamidinium cations: dielectric, optical and magnetic properties.
Mączka, Mirosław; Stefańska, Dagmara; Ptak, Maciej; Gągor, Anna; Pikul, Adam; Sieradzki, Adam; Dalton transactions (Cambridge, England : 2003) 50 (2021) 2639–2647; doi:10.1039/d0dt03995k

data_7706551
_publ_section_title
;
 Cadmium and manganese hypophosphite perovskites templated by
 formamidinium cations: dielectric, optical and magnetic properties.
;
_journal_issue                   7
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              2639
_journal_page_last               2647
_journal_paper_doi               10.1039/d0dt03995k
_journal_volume                  50
_journal_year                    2021
_chemical_formula_sum            'C H11 Cd N2 O6 P3'
_chemical_formula_weight         352.43
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;
2020-12-18 deposited with the CCDC.	2021-02-01 downloaded from the CCDC.
;
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_diffrn_ambient_environment      N~2~
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_diffrn_measurement_device       'four-circle diffractometer'
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_diffrn_radiation_monochromator  graphite
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_diffrn_reflns_av_unetI/netI     0.0184
_diffrn_reflns_Laue_measured_fraction_full 0.999
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_diffrn_reflns_limit_h_min       -17
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_diffrn_reflns_number            24121
_diffrn_reflns_point_group_measured_fraction_full 0.999
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_diffrn_reflns_theta_full        25.000
_diffrn_reflns_theta_max         26.369
_diffrn_reflns_theta_min         2.491
_diffrn_source                   'fine-focus sealed X-ray tube'
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_exptl_absorpt_process_details
;
CrysAlisPro 1.171.38.41 (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    2.286
_exptl_crystal_description       prism
_exptl_crystal_F_000             688
_exptl_crystal_preparation       'Magnetic properties'
_exptl_crystal_size_max          0.18
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_exptl_crystal_size_min          0.08
_refine_diff_density_max         0.831
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_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.079
_refine_ls_hydrogen_treatment    mixed
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_refine_ls_number_parameters     155
_refine_ls_number_reflns         2090
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.079
_refine_ls_R_factor_all          0.0360
_refine_ls_R_factor_gt           0.0274
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0182P)^2^+2.2267P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0544
_refine_ls_wR_factor_ref         0.0574
_reflns_Friedel_coverage         0.000
_reflns_number_gt                1644
_reflns_number_total             2090
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d0dt03995k2.cif
_cod_data_source_block           PhaseII
_cod_depositor_comments
'Adding full bibliography for 7706551--7706552.cif.'
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               7706551
_shelx_shelxl_version_number     2018/3
_oxdiff_exptl_absorpt_empirical_full_min 0.888
_oxdiff_exptl_absorpt_empirical_full_max 1.196
_oxdiff_exptl_absorpt_empirical_details
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_shelx_res_checksum              38407
_shelx_hkl_checksum              21793