Labile coodination dendrimersElectronic supplementary information (ESI) available: ESMS spectrum of 1 and dendron NMR data. See http://www.rsc.org/suppdata/cc/b1/b107658m/
Xu, Xingling; MacLean, Elizabeth J.; Teat, Simon J.; Nieuwenhuyzen, Mark; Chambers, Mark; James, Stuart L.; Chemical Communications  (2002) 78–; doi:10.1039/b107658m

data_7114561
_publ_section_title
;
 Labile coodination dendrimersElectronic supplementary information (ESI)
 available: ESMS spectrum of 1 and dendron NMR data. See
 http://www.rsc.org/suppdata/cc/b1/b107658m/
;
_journal_issue                   1
_journal_name_full               'Chemical Communications'
_journal_page_first              78
_journal_paper_doi               10.1039/b107658m
_journal_year                    2002
_chemical_formula_sum
'C219.45 H213.05 Ag6 F15.3 O19.7 P12 S3.45 Sb2.55'
_chemical_formula_weight         4896.18
_chemical_name_systematic
;
?
;
_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                 110.566(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   27.4440(12)
_cell_length_b                   25.3852(11)
_cell_length_c                   34.8363(15)
_cell_measurement_reflns_used    14728
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      23.38
_cell_measurement_theta_min      2.28
_cell_volume                     22722.7(17)
_computing_cell_refinement       'BRUKER AXS SAINT v6.02a'
_computing_data_collection       'Bruker AXS SMART v5.054'
_computing_data_reduction        'Bruker AXS SAINT v6.02a'
_computing_molecular_graphics    'Bruker AXS SHELXTL'
_computing_publication_material  'SHELXTL and local programs'
_computing_structure_refinement  'Bruker AXS SHELXTL'
_computing_structure_solution    'Bruker AXS SHELXTL'
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'Bruker AXS SMART CCD diffractometer'
_diffrn_measurement_method       '\w rotation with narrow frames'
_diffrn_radiation_monochromator  'Silicon 111'
_diffrn_radiation_source         'Daresbury SRS Station 9.8'
_diffrn_radiation_type           Synchrotron
_diffrn_radiation_wavelength     0.6923
_diffrn_reflns_av_R_equivalents  0.0777
_diffrn_reflns_av_sigmaI/netI    0.0905
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -25
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_limit_l_min       -32
_diffrn_reflns_number            53647
_diffrn_reflns_theta_full        19.00
_diffrn_reflns_theta_max         19.00
_diffrn_reflns_theta_min         1.78
_diffrn_standards_decay_%        15
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.991
_exptl_absorpt_correction_T_max  0.93
_exptl_absorpt_correction_T_min  0.55
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.431
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       lath
_exptl_crystal_F_000             9889
_exptl_crystal_size_max          0.62
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.06
_refine_diff_density_max         3.085
_refine_diff_density_min         -1.022
_refine_diff_density_rms         0.224
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.316
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1209
_refine_ls_number_reflns         19626
_refine_ls_number_restraints     1353
_refine_ls_restrained_S_all      1.565
_refine_ls_R_factor_all          0.1827
_refine_ls_R_factor_gt           0.1305
_refine_ls_shift/su_max          6.203
_refine_ls_shift/su_mean         0.147
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.2000P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.3440
_refine_ls_wR_factor_ref         0.3867
_reflns_number_gt                11319
_reflns_number_total             19626
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b107658m.txt
_cod_data_source_block           dart52
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_original_formula_sum
'C219.45 H213.05 Ag6 F15.30 O19.70 P12 S3.45 Sb2.55'
_cod_database_code               7114561