#------------------------------------------------------------------------------
#$Date: 2016-03-25 09:58:19 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179736 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/32/7003281.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7003281
loop_
_publ_author_name
'Izod, Keith'
'Stewart, John C.'
'Clegg, William'
'Harrington, Ross W.'
_publ_section_title
;
 Alkali metal complexes of a naphthylamine-substituted phosphanide
;
_journal_issue                   3
_journal_name_full               'Dalton Transactions'
_journal_page_first              363
_journal_paper_doi               10.1039/b715145d
_journal_year                    2008
_chemical_formula_moiety         'C28 H54 K N4 P Si2'
_chemical_formula_sum            'C28 H54 K N4 P Si2'
_chemical_formula_weight         573.00
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 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                 102.932(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.814(2)
_cell_length_b                   16.820(4)
_cell_length_c                   21.700(6)
_cell_measurement_reflns_used    9200
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      28.2
_cell_measurement_theta_min      2.26
_cell_volume                     3491.2(15)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL and local programs'
_computing_structure_refinement  'Bruker SHELXTL'
_computing_structure_solution    SIR97
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.988
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measurement_device_type  'Bruker SMART 1K CCD diffractometer'
_diffrn_measurement_method       'thin-slice ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0621
_diffrn_reflns_av_sigmaI/netI    0.0680
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            22770
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         0.96
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.288
_exptl_absorpt_correction_T_max  0.975
_exptl_absorpt_correction_T_min  0.920
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.090
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       rod
_exptl_crystal_F_000             1248
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.380
_refine_diff_density_min         -0.603
_refine_diff_density_rms         0.070
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.083
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     339
_refine_ls_number_reflns         6856
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.083
_refine_ls_R_factor_all          0.0800
_refine_ls_R_factor_gt           0.0449
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0280P)²+2.0832P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0849
_refine_ls_wR_factor_ref         0.0999
_reflns_number_gt                5143
_reflns_number_total             6856
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            b715145d.txt
_cod_data_source_block           ki292_4
_cod_original_cell_volume        3491.3(15)
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               7003281
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
K K 0.78795(8) 0.08892(4) 0.27969(4) 0.02822(18) Uani 1 1 d . . .
P P 1.03709(10) 0.15066(5) 0.38732(4) 0.02162(19) Uani 1 1 d . . .
Si1 Si 0.87073(11) 0.27648(6) 0.43633(5) 0.0280(2) Uani 1 1 d . . .
Si2 Si 1.20831(11) 0.27571(5) 0.47460(5) 0.0262(2) Uani 1 1 d . . .
N1 N 1.0466(3) -0.01218(15) 0.35033(13) 0.0267(7) Uani 1 1 d . . .
N2 N 0.6729(3) 0.18756(16) 0.17388(14) 0.0313(7) Uani 1 1 d . . .
N3 N 0.6040(3) 0.01224(16) 0.17902(14) 0.0312(7) Uani 1 1 d . . .
N4 N 0.5568(3) 0.01709(17) 0.31241(15) 0.0371(8) Uani 1 1 d . . .
C1 C 1.0433(4) 0.25826(17) 0.41461(15) 0.0228(7) Uani 1 1 d . . .
H1A H 1.0461 0.2924 0.3772 0.027 Uiso 1 1 calc R . .
C2 C 0.8166(4) 0.1934(2) 0.48382(18) 0.0389(10) Uani 1 1 d . . .
H2A H 0.8125 0.1435 0.4602 0.058 Uiso 1 1 calc R . .
H2B H 0.7243 0.2051 0.4918 0.058 Uiso 1 1 calc R . .
H2C H 0.8849 0.1884 0.5242 0.058 Uiso 1 1 calc R . .
C3 C 0.8671(5) 0.3705(2) 0.48324(18) 0.0430(11) Uani 1 1 d . . .
H3A H 0.7723 0.3794 0.4892 0.065 Uiso 1 1 calc R . .
H3B H 0.8953 0.4155 0.4603 0.065 Uiso 1 1 calc R . .
H3C H 0.9320 0.3653 0.5246 0.065 Uiso 1 1 calc R . .
C4 C 0.7334(4) 0.2890(2) 0.36227(18) 0.0394(10) Uani 1 1 d . . .
H4A H 0.7413 0.2461 0.3327 0.059 Uiso 1 1 calc R . .
H4B H 0.7459 0.3404 0.3430 0.059 Uiso 1 1 calc R . .
H4C H 0.6409 0.2871 0.3722 0.059 Uiso 1 1 calc R . .
C5 C 1.2319(4) 0.3842(2) 0.49534(18) 0.0395(10) Uani 1 1 d . . .
H5A H 1.1571 0.4017 0.5155 0.059 Uiso 1 1 calc R . .
H5B H 1.2281 0.4153 0.4568 0.059 Uiso 1 1 calc R . .
H5C H 1.3226 0.3923 0.5245 0.059 Uiso 1 1 calc R . .
C6 C 1.2045(4) 0.2178(2) 0.54784(15) 0.0356(9) Uani 1 1 d . . .
H6A H 1.1922 0.1612 0.5373 0.053 Uiso 1 1 calc R . .
H6B H 1.1266 0.2363 0.5656 0.053 Uiso 1 1 calc R . .
H6C H 1.2927 0.2255 0.5790 0.053 Uiso 1 1 calc R . .
C7 C 1.3687(4) 0.2421(2) 0.44801(18) 0.0386(9) Uani 1 1 d . . .
H7A H 1.3541 0.1880 0.4310 0.058 Uiso 1 1 calc R . .
H7B H 1.4492 0.2426 0.4841 0.058 Uiso 1 1 calc R . .
H7C H 1.3863 0.2780 0.4151 0.058 Uiso 1 1 calc R . .
C8 C 1.1077(3) 0.15302(18) 0.31720(15) 0.0206(7) Uani 1 1 d . . .
C9 C 1.1642(3) 0.22274(18) 0.29614(15) 0.0247(7) Uani 1 1 d . . .
H9A H 1.1767 0.2676 0.3234 0.030 Uiso 1 1 calc R . .
C10 C 1.2027(4) 0.23041(19) 0.23858(15) 0.0280(8) Uani 1 1 d . . .
H10A H 1.2418 0.2791 0.2286 0.034 Uiso 1 1 calc R . .
C11 C 1.1853(4) 0.16893(19) 0.19589(16) 0.0272(8) Uani 1 1 d . . .
H11A H 1.2082 0.1755 0.1559 0.033 Uiso 1 1 calc R . .
C12 C 1.1325(3) 0.09556(19) 0.21254(15) 0.0230(7) Uani 1 1 d . . .
C13 C 1.1048(4) 0.0343(2) 0.16709(17) 0.0289(8) Uani 1 1 d . . .
H13A H 1.1228 0.0430 0.1264 0.035 Uiso 1 1 calc R . .
C14 C 1.0528(4) -0.0371(2) 0.18047(18) 0.0357(9) Uani 1 1 d . . .
H14A H 1.0276 -0.0761 0.1482 0.043 Uiso 1 1 calc R . .
C15 C 1.0364(4) -0.0532(2) 0.24164(18) 0.0323(9) Uani 1 1 d . . .
H15A H 1.0067 -0.1045 0.2514 0.039 Uiso 1 1 calc R . .
C16 C 1.0628(3) 0.00471(18) 0.28831(16) 0.0230(7) Uani 1 1 d . . .
C17 C 1.1031(3) 0.08384(18) 0.27424(15) 0.0198(7) Uani 1 1 d . . .
C18 C 0.9550(4) -0.0780(2) 0.3580(2) 0.0414(10) Uani 1 1 d . . .
H18A H 0.8651 -0.0722 0.3277 0.062 Uiso 1 1 calc R . .
H18B H 0.9397 -0.0776 0.4011 0.062 Uiso 1 1 calc R . .
H18C H 0.9986 -0.1284 0.3503 0.062 Uiso 1 1 calc R . .
C19 C 1.1784(4) -0.0170(2) 0.39713(17) 0.0333(9) Uani 1 1 d . . .
H19A H 1.2363 0.0292 0.3929 0.050 Uiso 1 1 calc R . .
H19B H 1.2277 -0.0657 0.3903 0.050 Uiso 1 1 calc R . .
H19C H 1.1597 -0.0178 0.4396 0.050 Uiso 1 1 calc R . .
C20 C 0.8100(4) 0.1941(3) 0.1567(2) 0.0490(11) Uani 1 1 d . . .
H20A H 0.8747 0.2240 0.1895 0.074 Uiso 1 1 calc R . .
H20B H 0.7985 0.2218 0.1161 0.074 Uiso 1 1 calc R . .
H20C H 0.8477 0.1408 0.1531 0.074 Uiso 1 1 calc R . .
C21 C 0.6191(5) 0.2671(2) 0.1815(2) 0.0535(12) Uani 1 1 d . . .
H21A H 0.5307 0.2628 0.1952 0.080 Uiso 1 1 calc R . .
H21B H 0.6033 0.2955 0.1411 0.080 Uiso 1 1 calc R . .
H21C H 0.6871 0.2964 0.2134 0.080 Uiso 1 1 calc R . .
C22 C 0.5720(4) 0.1451(2) 0.12482(17) 0.0396(10) Uani 1 1 d . . .
H22A H 0.5721 0.1696 0.0833 0.047 Uiso 1 1 calc R . .
H22B H 0.4774 0.1523 0.1329 0.047 Uiso 1 1 calc R . .
C23 C 0.5998(5) 0.0573(2) 0.12090(18) 0.0432(10) Uani 1 1 d . . .
H23A H 0.5262 0.0342 0.0868 0.052 Uiso 1 1 calc R . .
H23B H 0.6903 0.0503 0.1086 0.052 Uiso 1 1 calc R . .
C24 C 0.6533(4) -0.0689(2) 0.1704(2) 0.0454(11) Uani 1 1 d . . .
H24A H 0.6625 -0.0988 0.2099 0.068 Uiso 1 1 calc R . .
H24B H 0.7443 -0.0662 0.1590 0.068 Uiso 1 1 calc R . .
H24C H 0.5858 -0.0956 0.1366 0.068 Uiso 1 1 calc R . .
C25 C 0.4666(4) 0.0094(2) 0.19573(18) 0.0378(10) Uani 1 1 d . . .
H25A H 0.4021 -0.0221 0.1632 0.045 Uiso 1 1 calc R . .
H25B H 0.4290 0.0642 0.1942 0.045 Uiso 1 1 calc R . .
C26 C 0.4665(4) -0.0254(2) 0.2596(2) 0.0409(10) Uani 1 1 d . . .
H26A H 0.3696 -0.0252 0.2658 0.049 Uiso 1 1 calc R . .
H26B H 0.4975 -0.0815 0.2603 0.049 Uiso 1 1 calc R . .
C27 C 0.5777(5) -0.0297(3) 0.3709(2) 0.0571(13) Uani 1 1 d . . .
H27A H 0.6183 -0.0814 0.3644 0.086 Uiso 1 1 calc R . .
H27B H 0.4876 -0.0377 0.3824 0.086 Uiso 1 1 calc R . .
H27C H 0.6413 -0.0012 0.4050 0.086 Uiso 1 1 calc R . .
C28 C 0.4959(4) 0.0946(2) 0.32326(19) 0.0420(10) Uani 1 1 d . . .
H28A H 0.4886 0.1282 0.2858 0.063 Uiso 1 1 calc R . .
H28B H 0.5559 0.1207 0.3598 0.063 Uiso 1 1 calc R . .
H28C H 0.4026 0.0865 0.3314 0.063 Uiso 1 1 calc R . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.2009 0.2494 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N4 K N3 65.40(9) . . ?
N4 K N2 104.96(9) . . ?
N3 K N2 64.69(8) . . ?
N4 K N1 104.71(8) . . ?
N3 K N1 115.89(8) . . ?
N2 K N1 146.65(9) . . ?
N4 K P 119.49(7) . . ?
N3 K P 168.82(7) . . ?
N2 K P 120.39(7) . . ?
N1 K P 53.95(5) . . ?
C8 P C1 104.45(14) . . ?
C8 P K 76.35(11) . . ?
C1 P K 120.63(11) . . ?
C4 Si1 C2 108.55(18) . . ?
C4 Si1 C1 108.66(17) . . ?
C2 Si1 C1 113.35(16) . . ?
C4 Si1 C3 105.87(18) . . ?
C2 Si1 C3 106.57(17) . . ?
C1 Si1 C3 113.49(17) . . ?
C1 Si2 C6 109.41(16) . . ?
C1 Si2 C7 113.28(16) . . ?
C6 Si2 C7 106.31(17) . . ?
C1 Si2 C5 111.19(16) . . ?
C6 Si2 C5 109.08(17) . . ?
C7 Si2 C5 107.39(18) . . ?
C16 N1 C19 113.7(3) . . ?
C16 N1 C18 117.5(3) . . ?
C19 N1 C18 110.6(3) . . ?
C16 N1 K 71.33(17) . . ?
C19 N1 K 149.5(2) . . ?
C18 N1 K 90.8(2) . . ?
C21 N2 C22 109.0(3) . . ?
C21 N2 C20 109.4(3) . . ?
C22 N2 C20 111.0(3) . . ?
C21 N2 K 122.0(2) . . ?
C22 N2 K 112.5(2) . . ?
C20 N2 K 91.6(2) . . ?
C23 N3 C24 108.5(3) . . ?
C23 N3 C25 112.2(3) . . ?
C24 N3 C25 110.2(3) . . ?
C23 N3 K 108.7(2) . . ?
C24 N3 K 110.6(2) . . ?
C25 N3 K 106.7(2) . . ?
C26 N4 C27 110.9(3) . . ?
C26 N4 C28 111.1(3) . . ?
C27 N4 C28 108.6(3) . . ?
C26 N4 K 113.2(2) . . ?
C27 N4 K 119.1(2) . . ?
C28 N4 K 92.3(2) . . ?
Si2 C1 Si1 119.37(17) . . ?
Si2 C1 P 109.29(16) . . ?
Si1 C1 P 105.37(16) . . ?
Si2 C1 H1A 107.4 . . ?
Si1 C1 H1A 107.4 . . ?
P C1 H1A 107.4 . . ?
Si1 C2 H2A 109.5 . . ?
Si1 C2 H2B 109.5 . . ?
H2A C2 H2B 109.5 . . ?
Si1 C2 H2C 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
Si1 C3 H3A 109.5 . . ?
Si1 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
Si1 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
Si1 C4 H4A 109.5 . . ?
Si1 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
Si1 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
Si2 C5 H5A 109.5 . . ?
Si2 C5 H5B 109.5 . . ?
H5A C5 H5B 109.5 . . ?
Si2 C5 H5C 109.5 . . ?
H5A C5 H5C 109.5 . . ?
H5B C5 H5C 109.5 . . ?
Si2 C6 H6A 109.5 . . ?
Si2 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
Si2 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
Si2 C7 H7A 109.5 . . ?
Si2 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
Si2 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C9 C8 C17 113.9(3) . . ?
C9 C8 P 122.8(2) . . ?
C17 C8 P 123.2(2) . . ?
C10 C9 C8 124.9(3) . . ?
C10 C9 H9A 117.6 . . ?
C8 C9 H9A 117.6 . . ?
C11 C10 C9 121.2(3) . . ?
C11 C10 H10A 119.4 . . ?
C9 C10 H10A 119.4 . . ?
C10 C11 C12 118.8(3) . . ?
C10 C11 H11A 120.6 . . ?
C12 C11 H11A 120.6 . . ?
C13 C12 C11 118.9(3) . . ?
C13 C12 C17 120.1(3) . . ?
C11 C12 C17 121.0(3) . . ?
C14 C13 C12 121.2(3) . . ?
C14 C13 H13A 119.4 . . ?
C12 C13 H13A 119.4 . . ?
C13 C14 C15 120.1(3) . . ?
C13 C14 H14A 120.0 . . ?
C15 C14 H14A 120.0 . . ?
C16 C15 C14 121.0(3) . . ?
C16 C15 H15A 119.5 . . ?
C14 C15 H15A 119.5 . . ?
C15 C16 N1 120.7(3) . . ?
C15 C16 C17 120.6(3) . . ?
N1 C16 C17 118.7(3) . . ?
C16 C17 C12 116.3(3) . . ?
C16 C17 C8 124.2(3) . . ?
C12 C17 C8 119.4(3) . . ?
N1 C18 H18A 109.5 . . ?
N1 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
N1 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
N1 C19 H19A 109.5 . . ?
N1 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
N1 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
N2 C20 H20A 109.5 . . ?
N2 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
N2 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
N2 C21 H21A 109.5 . . ?
N2 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
N2 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
N2 C22 C23 114.6(3) . . ?
N2 C22 H22A 108.6 . . ?
C23 C22 H22A 108.6 . . ?
N2 C22 H22B 108.6 . . ?
C23 C22 H22B 108.6 . . ?
H22A C22 H22B 107.6 . . ?
N3 C23 C22 115.4(3) . . ?
N3 C23 H23A 108.4 . . ?
C22 C23 H23A 108.4 . . ?
N3 C23 H23B 108.4 . . ?
C22 C23 H23B 108.4 . . ?
H23A C23 H23B 107.5 . . ?
N3 C24 H24A 109.5 . . ?
N3 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
N3 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
N3 C25 C26 115.4(3) . . ?
N3 C25 H25A 108.4 . . ?
C26 C25 H25A 108.4 . . ?
K C25 H25A 157.7 . . ?
N3 C25 H25B 108.4 . . ?
C26 C25 H25B 108.4 . . ?
K C25 H25B 87.0 . . ?
H25A C25 H25B 107.5 . . ?
N4 C26 C25 113.9(3) . . ?
N4 C26 H26A 108.8 . . ?
C25 C26 H26A 108.8 . . ?
N4 C26 H26B 108.8 . . ?
C25 C26 H26B 108.8 . . ?
H26A C26 H26B 107.7 . . ?
N4 C27 H27A 109.5 . . ?
N4 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
N4 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
N4 C28 H28A 109.5 . . ?
N4 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
N4 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
K N4 2.799(3) . ?
K N3 2.816(3) . ?
K N2 2.853(3) . ?
K N1 3.154(3) . ?
K P 3.1552(13) . ?
P C8 1.808(3) . ?
P C1 1.901(3) . ?
Si1 C4 1.864(4) . ?
Si1 C2 1.882(4) . ?
Si1 C1 1.882(4) . ?
Si1 C3 1.885(4) . ?
Si2 C1 1.860(4) . ?
Si2 C6 1.872(3) . ?
Si2 C7 1.881(4) . ?
Si2 C5 1.882(4) . ?
N1 C16 1.419(4) . ?
N1 C19 1.457(4) . ?
N1 C18 1.459(4) . ?
N2 C21 1.462(5) . ?
N2 C22 1.467(4) . ?
N2 C20 1.478(5) . ?
N3 C23 1.464(5) . ?
N3 C24 1.473(4) . ?
N3 C25 1.474(5) . ?
N4 C26 1.468(5) . ?
N4 C27 1.468(5) . ?
N4 C28 1.475(5) . ?
C1 H1A 1.000 . ?
C2 H2A 0.980 . ?
C2 H2B 0.980 . ?
C2 H2C 0.980 . ?
C3 H3A 0.980 . ?
C3 H3B 0.980 . ?
C3 H3C 0.980 . ?
C4 H4A 0.980 . ?
C4 H4B 0.980 . ?
C4 H4C 0.980 . ?
C5 H5A 0.980 . ?
C5 H5B 0.980 . ?
C5 H5C 0.980 . ?
C6 H6A 0.980 . ?
C6 H6B 0.980 . ?
C6 H6C 0.980 . ?
C7 H7A 0.980 . ?
C7 H7B 0.980 . ?
C7 H7C 0.980 . ?
C8 C9 1.416(4) . ?
C8 C17 1.485(4) . ?
C9 C10 1.390(5) . ?
C9 H9A 0.950 . ?
C10 C11 1.373(5) . ?
C10 H10A 0.950 . ?
C11 C12 1.416(5) . ?
C11 H11A 0.950 . ?
C12 C13 1.411(4) . ?
C12 C17 1.445(4) . ?
C13 C14 1.361(5) . ?
C13 H13A 0.950 . ?
C14 C15 1.399(5) . ?
C14 H14A 0.950 . ?
C15 C16 1.387(5) . ?
C15 H15A 0.950 . ?
C16 C17 1.441(4) . ?
C18 H18A 0.980 . ?
C18 H18B 0.980 . ?
C18 H18C 0.980 . ?
C19 H19A 0.980 . ?
C19 H19B 0.980 . ?
C19 H19C 0.980 . ?
C20 H20A 0.980 . ?
C20 H20B 0.980 . ?
C20 H20C 0.980 . ?
C21 H21A 0.980 . ?
C21 H21B 0.980 . ?
C21 H21C 0.980 . ?
C22 C23 1.508(5) . ?
C22 H22A 0.990 . ?
C22 H22B 0.990 . ?
C23 H23A 0.990 . ?
C23 H23B 0.990 . ?
C24 H24A 0.980 . ?
C24 H24B 0.980 . ?
C24 H24C 0.980 . ?
C25 C26 1.504(5) . ?
C25 H25A 0.990 . ?
C25 H25B 0.990 . ?
C26 H26A 0.990 . ?
C26 H26B 0.990 . ?
C27 H27A 0.980 . ?
C27 H27B 0.980 . ?
C27 H27C 0.980 . ?
C28 H28A 0.980 . ?
C28 H28B 0.980 . ?
C28 H28C 0.980 . ?
