Crystal structure of bis{(ethanol)[2-(salicylhydrazono)-propionato] di(2-fluorobenzyl)tin(IV)}, [(FC~6~H~4~CH~2~)~2~Sn(C~2~H~5~OH)(C~10~H~8~N~2~O~4~)]~2~
Feng, S.-C.; Yin, H.-D.; Li, D.-C.; Zeitschrift für Kristallographie - New Crystal Structures 220 (2005) 247–249; doi:

data_8101759
_publ_section_title
;
Crystal structure of bis{(ethanol)[2-(salicylhydrazono)-propionato]
di(2-fluorobenzyl)tin(IV)}, 
[(FC~6~H~4~CH~2~)~2~Sn(C~2~H~5~OH)(C~10~H~8~N~2~O~4~)]~2~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              247
_journal_page_last               249
_journal_volume                  220
_journal_year                    2005
_chemical_formula_moiety         (C7H6F)2Sn(C10H8N2O4)(CH3CH2OH)
_chemical_formula_sum            'C52 H52 F4 N4 O10 Sn2'
_chemical_formula_weight         1206.40
_chemical_name_systematic
; 
bis((ethanol-O)[\m-2-(salicylhydrazono)propionato-N,O,O']di(2-
fluorobenzyl)tin(IV)
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 92.407(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   11.1122(13)
_cell_length_b                   17.939(3)
_cell_length_c                   12.612(3)
_cell_measurement_reflns_used    5162
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      27.285
_cell_measurement_theta_min      2.271
_cell_volume                     2511.9(8)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.969
_diffrn_measured_fraction_theta_max 0.969
_diffrn_measurement_device_type  'Bruker SMART CCD'
_diffrn_measurement_method       phi/omega
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0353
_diffrn_reflns_av_sigmaI/netI    0.0435
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            12442
_diffrn_reflns_theta_full        25.02
_diffrn_reflns_theta_max         25.02
_diffrn_reflns_theta_min         1.98
_exptl_absorpt_coefficient_mu    1.072
_exptl_absorpt_correction_T_max  0.8388
_exptl_absorpt_correction_T_min  0.6862
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.595
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1216
_exptl_crystal_size_max          0.38
_exptl_crystal_size_mid          0.32
_exptl_crystal_size_min          0.17
_refine_diff_density_max         2.053
_refine_diff_density_min         -0.488
_refine_diff_density_rms         0.106
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.065
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     329
_refine_ls_number_reflns         4294
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.064
_refine_ls_R_factor_all          0.0634
_refine_ls_R_factor_gt           0.0462
_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^)+(0.0666P)^2^+2.8612P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1121
_refine_ls_wR_factor_ref         0.1241
_reflns_number_gt                3326
_reflns_number_total             4294
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            1267-1505.cff
_cod_data_source_block           041120c
_cod_original_cell_volume        2511.8(8)
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               8101759