New Strontium Polysulfides, SrS3, and Sr2(OH)2S4.10H2O, Obtained by the High-pressure Treatment of a Sr-S Mixture
Hiroshi Fukuoka; Rimiko Suga; Kenji Komaguchi; Shoji Yamanaka; Masaru Shiotani; Inorganic Chemistry 43 (2004) 5780–5784; doi:10.1021/ic0494612

data_4311492
_publ_contact_author_email       hfukuoka@hiroshima-u.ac.jp
_publ_contact_author_fax         +81-824-24-5494
_publ_contact_author_name        'Hiroshi Fukuoka'
_publ_contact_author_phone       +81-824-24-7742
_publ_section_title
;
 New Strontium Polysulfides, SrS3, and Sr2(OH)2S4.10H2O, Obtained by the
 High-pressure Treatment of a Sr-S Mixture
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              5780
_journal_page_last               5784
_journal_paper_doi               10.1021/ic0494612
_journal_volume                  43
_journal_year                    2004
_chemical_formula_moiety         'H22 O12 S4 Sr2'
_chemical_formula_sum            'H22 O12 S4 Sr2'
_chemical_formula_weight         517.64
_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'
_audit_creation_date             2003-01-14
_audit_creation_method           'by CrystalStructure v3.10'
_cell_angle_alpha                75.639(6)
_cell_angle_beta                 73.824(3)
_cell_angle_gamma                71.639(3)
_cell_formula_units_Z            1
_cell_length_a                   5.9107(5)
_cell_length_b                   7.8682(6)
_cell_length_c                   9.4134(6)
_cell_measurement_reflns_used    1459
_cell_measurement_temperature    296.1
_cell_measurement_theta_max      27.4
_cell_measurement_theta_min      3.3
_cell_volume                     392.83(5)
_computing_cell_refinement       PROCESS-AUTO
_computing_data_collection       PROCESS-AUTO
_computing_data_reduction        CrystalStructure
_computing_publication_material  'CrystalStructure Ver. 3.10'
_computing_structure_refinement  CRYSTALS
_computing_structure_solution    SIR92
_diffrn_detector_area_resol_mean 10.00
_diffrn_measured_fraction_theta_full 0.9844
_diffrn_measured_fraction_theta_max 0.9844
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a  graphite monochromated'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.016
_diffrn_reflns_limit_h_max       7
_diffrn_reflns_limit_h_min       -6
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -9
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            3706
_diffrn_reflns_theta_full        27.40
_diffrn_reflns_theta_max         27.40
_exptl_absorpt_coefficient_mu    7.355
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            plate
_exptl_crystal_density_diffrn    2.188
_exptl_crystal_density_meas      2.22
_exptl_crystal_density_method
'picnometer method using benzene-diiodemethane solution'
_exptl_crystal_description       unknown
_exptl_crystal_F_000             258.00
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.10
_refine_diff_density_max         1.09
_refine_diff_density_min         -1.03
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.676
_refine_ls_hydrogen_treatment    none
_refine_ls_number_parameters     82
_refine_ls_number_reflns         1610
_refine_ls_R_factor_gt           0.0320
_refine_ls_shift/su_max          0.0000
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1.0'
_refine_ls_weighting_scheme      unit
_refine_ls_wR_factor_ref         0.0430
_reflns_number_gt                1610
_reflns_number_total             1767
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            ic0494612si20040427_044323.cif
_cod_data_source_block           '_Sr2(OH)2S4.10H2O'
_cod_depositor_comments
;

2017-09-03
Z value and formula fixed to values more according to usual
chemical conventions.                 miguel
;
_cod_original_formula_weight         258.82
_cod_original_formula_moiety         'H11 O6 S2 Sr '
_cod_original_formula_units_Z            2
_cod_original_sg_symbol_H-M      'P -1 '
_cod_original_formula_sum        'H11 O6 S2 Sr '
_cod_database_code               4311492