Metal array fabrication through self-assembly of Pt-complex-bound amino acids
Katsuhiro Isozaki; Kazuki Ogata; Yusuke Haga; Daisuke Sasano; Tetsuya Ogawa; Hiroki Kurata; Masaharu Nakamura; Takeshi Naota; Hikaru Takaya; Chem.Commun. 48 (2012) 3936–; doi:10.1039/c2cc17530d

data_7107566
_publ_section_title
;
 Metal array fabrication through self-assembly of Pt-complex-bound amino
 acids
;
_journal_name_full               Chem.Commun.
_journal_page_first              3936
_journal_paper_doi               10.1039/c2cc17530d
_journal_volume                  48
_journal_year                    2012
_chemical_formula_moiety         'C58 H58 Cl2 N2 O4 P2 Pt2'
_chemical_formula_sum            'C58 H58 Cl2 N2 O4 P2 Pt2'
_chemical_formula_weight         1370.14
_space_group_IT_number           9
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      9
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                90.0000
_cell_angle_beta                 101.3565(8)
_cell_angle_gamma                90.0000
_cell_formula_units_Z            4
_cell_length_a                   13.5149(4)
_cell_length_b                   14.1091(4)
_cell_length_c                   27.8446(7)
_cell_measurement_reflns_used    36808
_cell_measurement_temperature    113
_cell_measurement_theta_max      27.39
_cell_measurement_theta_min      2.98
_cell_volume                     5205.5(3)
_computing_cell_refinement       'RAPID AUTO'
_computing_data_collection       'RAPID AUTO (Rigaku, ????)'
_computing_data_reduction        'RAPID AUTO'
_computing_molecular_graphics    'CrystalStructure 4.0'
_computing_publication_material  'CrystalStructure 4.0 (Rigaku, 2010)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'Il Milione (Burla, et al., 2007)'
_diffrn_ambient_temperature      113
_diffrn_detector_area_resol_mean 10.000
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.0379
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_limit_l_min       -33
_diffrn_reflns_number            33149
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    5.561
_exptl_absorpt_correction_T_max  0.573
_exptl_absorpt_correction_T_min  0.430
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'ABSCOR (Rigaku, 1995)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.748
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2688.00
_exptl_crystal_size_max          0.100
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.100
_refine_diff_density_max         0.810
_refine_diff_density_min         -0.460
_refine_ls_abs_structure_details
'Flack, H. D. (1983), Acta Cryst. A39, 876-881. 4235 Friedel Pairs'
_refine_ls_abs_structure_Flack   0.141(5)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.070
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_parameters     640
_refine_ls_number_reflns         8823
_refine_ls_number_restraints     2
_refine_ls_R_factor_gt           0.0223
_refine_ls_shift/su_max          0.002
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[\s^2^(Fo^2^)+(0.0223P)^2^+31.3401P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.0573
_reflns_number_gt                8683
_reflns_number_total             8825
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            c2cc17530d.txt
_cod_data_source_block           PtOH2
_cod_database_code               7107566