#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/92/7009215.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_7009215
loop_
_publ_author_name
'Raston, Colin L.'
'Skelton, Brian W.'
'Tolhurst, Vicki-Anne'
'White, Allan H.'
_publ_section_title
;
 Geminal arsa(III)amide and trisubstituted antimony and bismuth amides
 from the sterically hindered, N-functionalised amido ligand
 [{2-(6-Me)C5H3N}NSiMe3]−
;
_journal_issue                   8
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              1279
_journal_paper_doi               10.1039/a909338i
_journal_year                    2000
_chemical_formula_sum            'C27 H45 N6 Sb Si3'
_chemical_formula_weight         659.72
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_audit_creation_date             97-01-24
_audit_creation_method           from_xtal_archive_file_using_CIFIO
_cell_angle_alpha                116.13(9)
_cell_angle_beta                 94.04(5)
_cell_angle_gamma                104.01(7)
_cell_formula_units_Z            2
_cell_length_a                   14.865(6)
_cell_length_b                   11.682(17)
_cell_length_c                   11.296(10)
_cell_measurement_reflns_used    8
_cell_measurement_temperature    293
_cell_measurement_theta_max      23.1
_cell_measurement_theta_min      18.6
_cell_volume                     1673(3)
_computing_cell_refinement       'Enraf Nonius software'
_computing_data_collection       'Enraf Nonius software'
_computing_data_reduction        xtal_DIFDAT_ABSORB_SORTRF_ADDREF
_computing_molecular_graphics    xtal
_computing_publication_material  xtal_BONDLA_CIFIO
_computing_structure_refinement  xtal_CRYLSQ
_computing_structure_solution    xtal
_diffrn_ambient_temperature      293
_diffrn_measurement_device       CAD4
_diffrn_measurement_method       '2θ-ω scans'
_diffrn_radiation_detector       'single counter'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'sealed tube'
_diffrn_radiation_type           Mo-K\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  .021
_diffrn_reflns_av_sigmaI/netI    .021
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       4
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            6511
_diffrn_reflns_reduction_process equatorial_monochr_Lp
_diffrn_reflns_theta_max         22.51
_diffrn_reflns_theta_min         1.44
_diffrn_standards_decay_%        0
_diffrn_standards_interval_time  60
_diffrn_standards_number         8
_exptl_absorpt_coefficient_mu    0.96
_exptl_absorpt_correction_T_max  .81
_exptl_absorpt_correction_T_min  .68
_exptl_absorpt_correction_type   gaussian
_exptl_absorpt_process_details   'XTAL absorb'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.31
_exptl_crystal_description       fragmant
_exptl_crystal_F_000             684
_exptl_crystal_size_max          0.65
_exptl_crystal_size_mid          0.50
_exptl_crystal_size_min          0.25
_refine_diff_density_max         .441
_refine_diff_density_min         -.542
_refine_ls_abs_structure_details none
_refine_ls_extinction_coef       6127(287)
_refine_ls_extinction_expression Eq22_p292_"Cryst._Comp."_Munksgaard_1970
_refine_ls_extinction_method     Zachariasen
_refine_ls_goodness_of_fit_all   1.378
_refine_ls_goodness_of_fit_ref   1.458
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           atomblock
_refine_ls_number_constraints    0
_refine_ls_number_parameters     336
_refine_ls_number_reflns         4017
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          .028
_refine_ls_R_factor_gt           .025
_refine_ls_shift/su_max          .087
_refine_ls_shift/su_mean         .007
_refine_ls_structure_factor_coef F
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_all         .032
_refine_ls_wR_factor_ref         .032
_reflns_d_resolution_high        .928
_reflns_d_resolution_low         14.122
_reflns_limit_h_max              16
_reflns_limit_h_min              0
_reflns_limit_k_max              12
_reflns_limit_k_min              -12
_reflns_limit_l_max              12
_reflns_limit_l_min              -12
_reflns_number_gt                4017
_reflns_number_total             4362
_reflns_threshold_expression     refl_observed_if_I____>3.000_sigma(I___)
_cod_data_source_file            a909338i.txt
_cod_data_source_block           vtb38
_cod_original_sg_symbol_Hall     -p_1
_cod_original_sg_symbol_H-M      p_-1
_cod_database_code               7009215
loop_
_symmetry_equiv_pos_as_xyz
+x,+y,+z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_thermal_displace_type
_atom_site_calc_flag
_atom_site_calc_attached_atom
Sb .189321(13) .152869(19) .14247(2) .03408(12) Uani ? ?
N11 .22008(18) -.0757(2) .0061(3) .0422(12) Uani ? ?
C12 .2569(2) -.0571(3) .1268(3) .0406(14) Uani ? ?
N12 .27253(17) .0706(2) .2302(3) .0382(11) Uani ? ?
Si1 .32004(7) .11196(10) .39564(10) .0478(4) Uani ? ?
C121 .4343(3) .0727(4) .4068(4) .072(2) Uani ? ?
C122 .2349(3) .0200(5) .4617(5) .077(2) Uani ? ?
C123 .3509(3) .2928(4) .5113(4) .075(2) Uani ? ?
C13 .2750(3) -.1660(3) .1377(4) .0552(17) Uani ? ?
C14 .2571(3) -.2850(3) .0247(4) .0611(18) Uani ? ?
C15 .2183(3) -.3022(3) -.0987(4) .0580(17) Uani ? ?
C16 .1983(2) -.1955(3) -.1048(4) .0503(15) Uani ? ?
C161 .1493(3) -.2052(4) -.2298(4) .071(2) Uani ? ?
N21 .16127(18) .2865(2) .0184(3) .0428(12) Uani ? ?
C22 .2402(2) .2669(3) -.0260(3) .0422(14) Uani ? ?
N22 .29072(17) .2210(2) .0416(3) .0418(12) Uani ? ?
Si2 .39725(7) .18992(11) .00069(12) .0547(5) Uani ? ?
C221 .4837(3) .3380(5) .0035(6) .098(3) Uani ? ?
C222 .3763(3) .0465(5) -.1709(5) .083(2) Uani ? ?
C223 .4581(3) .1553(5) .1236(5) .079(2) Uani ? ?
C23 .2622(3) .2908(4) -.1334(4) .0591(18) Uani ? ?
C24 .2022(3) .3346(4) -.1891(4) .066(2) Uani ? ?
C25 .1210(3) .3521(4) -.1427(4) .0609(18) Uani ? ?
C26 .1015(2) .3246(3) -.0406(4) .0489(15) Uani ? ?
C261 .0126(3) .3323(4) .0118(5) .077(2) Uani ? ?
Si3 .28065(7) .50980(9) .36523(12) .0571(5) Uani ? ?
N31 .10253(17) .1884(2) .3441(3) .0397(11) Uani ? ?
C32 .1453(2) .3195(3) .3857(3) .0378(13) Uani ? ?
N32 .21559(16) .3442(2) .3203(3) .0388(11) Uani ? ?
C321 .3346(3) .6065(4) .5496(5) .080(2) Uani ? ?
C322 .2053(4) .5996(4) .3249(5) .091(3) Uani ? ?
C323 .3798(3) .5190(4) .2783(5) .101(3) Uani ? ?
C33 .1140(2) .4152(3) .4885(4) .0456(14) Uani ? ?
C34 .0432(2) .3734(3) .5430(4) .0509(15) Uani ? ?
C35 -.0002(2) .2384(4) .4983(4) .0512(16) Uani ? ?
C36 .0304(2) .1478(3) .3950(3) .0432(14) Uani ? ?
C361 -.0168(3) -.0006(4) .3294(4) .0623(18) Uani ? ?
H121a .42656 -.01875 .34740 .10600 Uiso ? ?
H121b .48024 .12419 .37294 .10600 Uiso ? ?
H121c .46280 .09743 .49338 .10600 Uiso ? ?
H122a .17630 .03926 .46069 .11700 Uiso ? ?
H122b .22140 -.07605 .40703 .11700 Uiso ? ?
H122c .25958 .04070 .55235 .11700 Uiso ? ?
H123a .39765 .34215 .48026 .09900 Uiso ? ?
H123b .29684 .32316 .51189 .09900 Uiso ? ?
H123c .37803 .31946 .60189 .09900 Uiso ? ?
H13 .29858 -.15443 .22365 .06700 Uiso ? ?
H14 .27374 -.35719 .02851 .07300 Uiso ? ?
H15 .20476 -.38659 -.17821 .07000 Uiso ? ?
H161a .16205 -.27738 -.30405 .10400 Uiso ? ?
H161b .08255 -.23164 -.23174 .10400 Uiso ? ?
H161c .16591 -.11861 -.24715 .10400 Uiso ? ?
H221a .45948 .36699 -.05167 .15800 Uiso ? ?
H221b .49936 .41576 .09880 .15800 Uiso ? ?
H221c .54382 .32636 -.01202 .15800 Uiso ? ?
H222a .33274 -.03234 -.17547 .12600 Uiso ? ?
H222b .34677 .06592 -.23535 .12600 Uiso ? ?
H222c .43224 .02793 -.19419 .12600 Uiso ? ?
H223a .47162 .23406 .20919 .12600 Uiso ? ?
H223b .41774 .08237 .12522 .12600 Uiso ? ?
H223c .51542 .14073 .10089 .12600 Uiso ? ?
H23 .32146 .28443 -.16830 .08500 Uiso ? ?
H24 .21474 .34047 -.26903 .09100 Uiso ? ?
H25 .07770 .37837 -.18359 .07600 Uiso ? ?
H261a -.01090 .39713 .00423 .11700 Uiso ? ?
H261b .02556 .35772 .10867 .11700 Uiso ? ?
H261c -.03748 .25187 -.02586 .11700 Uiso ? ?
H321a .28673 .60506 .60346 .09200 Uiso ? ?
H321b .37643 .56088 .57247 .09200 Uiso ? ?
H321c .37069 .69386 .57783 .09200 Uiso ? ?
H322a .17967 .55540 .23052 .12900 Uiso ? ?
H322b .15486 .60334 .37226 .12900 Uiso ? ?
H322c .24026 .69122 .34901 .12900 Uiso ? ?
H323a .42235 .47831 .30296 .11700 Uiso ? ?
H323b .35785 .47247 .18504 .11700 Uiso ? ?
H323c .41658 .60895 .30402 .11700 Uiso ? ?
H33 .14087 .51101 .51311 .05600 Uiso ? ?
H34 .02401 .43678 .61970 .06300 Uiso ? ?
H35 -.05249 .20904 .53630 .05500 Uiso ? ?
H361a -.07963 -.02117 .26013 .09000 Uiso ? ?
H361b -.03500 -.02954 .39530 .09000 Uiso ? ?
H361c .02340 -.05025 .28305 .09000 Uiso ? ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_oxidation_number
_atom_type_number_in_cell
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C ? 0 54 .002 .002 Int._Tables_Vol_IV_Tables_2.2B_and_2.3.1
N ? 0 12 .004 .003 Int._Tables_Vol_IV_Tables_2.2B_and_2.3.1
Sb ? 0 2 -.816 1.546 Int._Tables_Vol_IV_Tables_2.2B_and_2.3.1
Si ? 0 6 .072 .071 Int._Tables_Vol_IV_Tables_2.2B_and_2.3.1
H ? 0 90 0 0 Int._Tables_Vol_IV_Tables_2.2B_and_2.3.1
loop_
_diffrn_attenuator_code
_diffrn_attenuator_scale
? ?
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
7 6 5
13 0 0
0 9 0
0 0 11
-7 -6 -5
-13 0 0
0 -9 0
0 0 -11
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_2
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N11 Sb N12 56.25(11) . . . ?
N11 Sb N21 118.60(12) . . . ?
N11 Sb N22 83.84(13) . . . ?
N11 Sb N31 119.30(11) . . . ?
N11 Sb N32 152.91(11) . . . ?
N12 Sb N21 155.14(10) . . . ?
N12 Sb N22 99.28(12) . . . ?
N12 Sb N31 84.82(11) . . . ?
N12 Sb N32 97.14(14) . . . ?
N21 Sb N22 56.28(11) . . . ?
N21 Sb N31 114.75(11) . . . ?
N21 Sb N32 82.97(15) . . . ?
N22 Sb N31 153.13(9) . . . ?
N22 Sb N32 97.05(13) . . . ?
N31 Sb N32 56.09(11) . . . ?
Sb N11 C12 84.5(2) . . . ?
Sb N11 C16 150.3(3) . . . ?
C12 N11 C16 121.8(4) . . . ?
N11 C12 N12 114.3(4) . . . ?
N11 C12 C13 118.9(3) . . . ?
N12 C12 C13 126.7(4) . . . ?
Sb N12 C12 102.7(2) . . . ?
Sb N12 Si1 134.26(15) . . . ?
C12 N12 Si1 120.3(3) . . . ?
N12 Si1 C121 111.69(18) . . . ?
N12 Si1 C122 110.85(17) . . . ?
N12 Si1 C123 112.4(2) . . . ?
C121 Si1 C122 108.8(3) . . . ?
C121 Si1 C123 104.34(19) . . . ?
C122 Si1 C123 108.5(2) . . . ?
Si1 C121 H121a 111.1(3) . . . ?
Si1 C121 H121b 108.3(4) . . . ?
Si1 C121 H121c 113.9(4) . . . ?
H121a C121 H121b 104.7(4) . . . ?
H121a C121 H121c 111.6(6) . . . ?
H121b C121 H121c 106.6(3) . . . ?
Si1 C122 H122a 111.8(5) . . . ?
Si1 C122 H122b 110.5(4) . . . ?
Si1 C122 H122c 112.4(3) . . . ?
H122a C122 H122b 107.6(4) . . . ?
H122a C122 H122c 108.0(5) . . . ?
H122b C122 H122c 106.4(6) . . . ?
Si1 C123 H123a 109.5(3) . . . ?
Si1 C123 H123b 110.8(3) . . . ?
Si1 C123 H123c 114.9(4) . . . ?
H123a C123 H123b 106.8(5) . . . ?
H123a C123 H123c 106.2(3) . . . ?
H123b C123 H123c 108.2(4) . . . ?
C12 C13 C14 119.1(4) . . . ?
C12 C13 H13 119.3(3) . . . ?
C14 C13 H13 121.6(5) . . . ?
C13 C14 C15 120.9(4) . . . ?
C13 C14 H14 120.5(5) . . . ?
C15 C14 H14 118.6(3) . . . ?
C14 C15 C16 118.4(3) . . . ?
C14 C15 H15 120.9(5) . . . ?
C16 C15 H15 120.7(5) . . . ?
N11 C16 C15 120.7(4) . . . ?
N11 C16 C161 116.0(4) . . . ?
C15 C16 C161 123.2(3) . . . ?
C16 C161 H161a 106.5(4) . . . ?
C16 C161 H161b 106.8(4) . . . ?
C16 C161 H161c 119.7(3) . . . ?
H161a C161 H161b 107.5(3) . . . ?
H161a C161 H161c 107.8(5) . . . ?
H161b C161 H161c 108.0(5) . . . ?
Sb N21 C22 84.9(2) . . . ?
Sb N21 C26 149.7(2) . . . ?
C22 N21 C26 121.2(4) . . . ?
N21 C22 N22 113.5(4) . . . ?
N21 C22 C23 119.3(4) . . . ?
N22 C22 C23 127.3(3) . . . ?
Sb N22 C22 103.0(2) . . . ?
Sb N22 Si2 133.4(2) . . . ?
C22 N22 Si2 121.1(3) . . . ?
N22 Si2 C221 112.1(2) . . . ?
N22 Si2 C222 111.19(18) . . . ?
N22 Si2 C223 111.5(2) . . . ?
C221 Si2 C222 107.2(3) . . . ?
C221 Si2 C223 105.5(2) . . . ?
C222 Si2 C223 109.1(3) . . . ?
Si2 C221 H221a 113.1(3) . . . ?
Si2 C221 H221b 108.1(5) . . . ?
Si2 C221 H221c 113.9(5) . . . ?
H221a C221 H221b 106.2(5) . . . ?
H221a C221 H221c 111.5(7) . . . ?
H221b C221 H221c 103.3(4) . . . ?
Si2 C222 H222a 109.4(4) . . . ?
Si2 C222 H222b 109.2(4) . . . ?
Si2 C222 H222c 112.4(3) . . . ?
H222a C222 H222b 107.2(4) . . . ?
H222a C222 H222c 109.0(5) . . . ?
H222b C222 H222c 109.5(6) . . . ?
Si2 C223 H223a 106.3(5) . . . ?
Si2 C223 H223b 108.3(3) . . . ?
Si2 C223 H223c 110.1(5) . . . ?
H223a C223 H223b 110.9(6) . . . ?
H223a C223 H223c 109.0(3) . . . ?
H223b C223 H223c 112.1(6) . . . ?
C22 C23 C24 118.7(4) . . . ?
C22 C23 H23 124.1(5) . . . ?
C24 C23 H23 117.0(5) . . . ?
C23 C24 C25 120.8(5) . . . ?
C23 C24 H24 117.2(5) . . . ?
C25 C24 H24 121.5(5) . . . ?
C24 C25 C26 118.4(5) . . . ?
C24 C25 H25 121.2(5) . . . ?
C26 C25 H25 120.3(4) . . . ?
N21 C26 C25 121.5(4) . . . ?
N21 C26 C261 115.7(4) . . . ?
C25 C26 C261 122.8(4) . . . ?
C26 C261 H261a 112.7(5) . . . ?
C26 C261 H261b 109.1(4) . . . ?
C26 C261 H261c 116.1(4) . . . ?
H261a C261 H261b 107.0(4) . . . ?
H261a C261 H261c 107.6(4) . . . ?
H261b C261 H261c 103.6(6) . . . ?
N32 Si3 C321 111.0(2) . . . ?
N32 Si3 C322 111.80(18) . . . ?
N32 Si3 C323 112.70(18) . . . ?
C321 Si3 C322 108.4(2) . . . ?
C321 Si3 C323 105.8(2) . . . ?
C322 Si3 C323 106.8(3) . . . ?
Sb N31 C32 83.8(2) . . . ?
Sb N31 C36 150.58(17) . . . ?
C32 N31 C36 121.7(3) . . . ?
N31 C32 N32 114.5(3) . . . ?
N31 C32 C33 118.5(3) . . . ?
N32 C32 C33 127.0(3) . . . ?
Sb N32 Si3 134.1(2) . . . ?
Sb N32 C32 103.23(17) . . . ?
Si3 N32 C32 120.3(2) . . . ?
Si3 C321 H321a 111.3(3) . . . ?
Si3 C321 H321b 109.4(3) . . . ?
Si3 C321 H321c 114.2(5) . . . ?
H321a C321 H321b 104.1(5) . . . ?
H321a C321 H321c 109.9(4) . . . ?
H321b C321 H321c 107.4(4) . . . ?
Si3 C322 H322a 110.4(4) . . . ?
Si3 C322 H322b 110.6(5) . . . ?
Si3 C322 H322c 112.8(4) . . . ?
H322a C322 H322b 109.0(5) . . . ?
H322a C322 H322c 106.7(6) . . . ?
H322b C322 H322c 107.1(4) . . . ?
Si3 C323 H323a 108.2(5) . . . ?
Si3 C323 H323b 110.4(3) . . . ?
Si3 C323 H323c 113.2(4) . . . ?
H323a C323 H323b 109.1(5) . . . ?
H323a C323 H323c 106.5(4) . . . ?
H323b C323 H323c 109.3(7) . . . ?
C32 C33 C34 119.5(3) . . . ?
C32 C33 H33 118.7(4) . . . ?
C34 C33 H33 121.6(3) . . . ?
C33 C34 C35 121.1(3) . . . ?
C33 C34 H34 121.5(3) . . . ?
C35 C34 H34 117.3(4) . . . ?
C34 C35 C36 117.8(4) . . . ?
C34 C35 H35 120.6(3) . . . ?
C36 C35 H35 121.6(4) . . . ?
N31 C36 C35 121.3(3) . . . ?
N31 C36 C361 115.9(3) . . . ?
C35 C36 C361 122.7(4) . . . ?
C36 C361 H361a 106.4(4) . . . ?
C36 C361 H361b 111.5(3) . . . ?
C36 C361 H361c 112.2(3) . . . ?
H361a C361 H361b 109.2(4) . . . ?
H361a C361 H361c 110.5(4) . . . ?
H361b C361 H361c 107.1(5) . . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Sb N11 2.604(4) . . ?
Sb N12 2.163(4) . . ?
Sb N21 2.595(4) . . ?
Sb N22 2.159(3) . . ?
Sb N31 2.620(3) . . ?
Sb N32 2.167(3) . . ?
N11 C12 1.335(5) . . ?
N11 C16 1.346(4) . . ?
C12 N12 1.379(4) . . ?
C12 C13 1.416(6) . . ?
N12 Si1 1.755(4) . . ?
Si1 C121 1.873(5) . . ?
Si1 C122 1.869(6) . . ?
Si1 C123 1.842(5) . . ?
C121 H121a .951(4) . . ?
C121 H121b 1.008(5) . . ?
C121 H121c .923(5) . . ?
C122 H122a .951(5) . . ?
C122 H122b .971(5) . . ?
C122 H122c .964(5) . . ?
C123 H123a .978(5) . . ?
C123 H123b .954(5) . . ?
C123 H123c .952(5) . . ?
C13 C14 1.358(5) . . ?
C13 H13 .947(5) . . ?
C14 C15 1.379(7) . . ?
C14 H14 .952(5) . . ?
C15 C16 1.377(7) . . ?
C15 H15 .958(3) . . ?
C16 C161 1.488(7) . . ?
C161 H161a .963(4) . . ?
C161 H161b .961(4) . . ?
C161 H161c 1.087(5) . . ?
N21 C22 1.339(4) . . ?
N21 C26 1.342(6) . . ?
C22 N22 1.382(6) . . ?
C22 C23 1.403(7) . . ?
N22 Si2 1.757(3) . . ?
Si2 C221 1.875(6) . . ?
Si2 C222 1.861(4) . . ?
Si2 C223 1.845(6) . . ?
C221 H221a .920(7) . . ?
C221 H221b 1.019(5) . . ?
C221 H221c .953(5) . . ?
C222 H222a .967(5) . . ?
C222 H222b .960(6) . . ?
C222 H222c .936(5) . . ?
C223 H223a .960(4) . . ?
C223 H223b .924(5) . . ?
C223 H223c .939(4) . . ?
C23 C24 1.370(7) . . ?
C23 H23 .996(4) . . ?
C24 C25 1.373(6) . . ?
C24 H24 .963(5) . . ?
C25 C26 1.359(7) . . ?
C25 H25 .949(5) . . ?
C26 C261 1.492(6) . . ?
C261 H261a .940(6) . . ?
C261 H261b .989(6) . . ?
C261 H261c .940(4) . . ?
Si3 N32 1.759(4) . . ?
Si3 C321 1.874(5) . . ?
Si3 C322 1.865(6) . . ?
Si3 C323 1.836(6) . . ?
N31 C32 1.350(4) . . ?
N31 C36 1.337(5) . . ?
C32 N32 1.369(5) . . ?
C32 C33 1.413(5) . . ?
C321 H321a .969(5) . . ?
C321 H321b .998(5) . . ?
C321 H321c .925(4) . . ?
C322 H322a .955(5) . . ?
C322 H322b .950(6) . . ?
C322 H322c .971(5) . . ?
C323 H323a .970(6) . . ?
C323 H323b .935(5) . . ?
C323 H323c .958(5) . . ?
C33 C34 1.355(6) . . ?
C33 H33 .992(4) . . ?
C34 C35 1.385(5) . . ?
C34 H34 .975(4) . . ?
C35 C36 1.382(5) . . ?
C35 H35 .976(4) . . ?
C36 C361 1.501(5) . . ?
C361 H361a 1.079(4) . . ?
C361 H361b .973(5) . . ?
C361 H361c .956(4) . . ?
loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_site_symmetry_1
_geom_contact_site_symmetry_2
_geom_contact_publ_flag
Sb C12 2.810(5) . . ?
Sb C22 2.814(5) . . ?
Sb C32 2.815(4) . . ?
N11 N12 2.280(4) . . ?
N11 C13 2.369(6) . . ?
N11 C14 2.722(7) . . ?
N11 C15 2.367(6) . . ?
N11 C161 2.405(5) . . ?
C12 Si1 2.724(4) . . ?
C12 C14 2.391(6) . . ?
C12 C15 2.755(5) . . ?
C12 C16 2.343(5) . . ?
C12 H13 2.053(5) . . ?
C12 H223b 2.553(3) . . ?
N12 C122 2.985(7) . . ?
N12 C123 2.989(5) . . ?
N12 C13 2.498(6) . . ?
N12 H223b 2.539(3) . . ?
Si1 H121a 2.386(2) . . ?
Si1 H121b 2.3897(14) . . ?
Si1 H121c 2.4001(14) . . ?
Si1 H122a 2.3914(14) . . ?
Si1 H122b 2.389(3) . . ?
Si1 H122c 2.407(2) . . ?
Si1 H123a 2.357(4) . . ?
Si1 H123b 2.356(3) . . ?
Si1 H123c 2.404(2) . . ?
C121 C123 2.934(7) . . ?
C13 C15 2.380(6) . . ?
C13 C16 2.731(7) . . ?
C13 H14 2.015(4) . . ?
C14 C16 2.367(7) . . ?
C14 H13 2.022(4) . . ?
C14 H15 2.043(4) . . ?
C15 C161 2.521(8) . . ?
C15 H14 2.015(5) . . ?
C15 H161a 2.569(5) . . ?
C16 H15 2.040(5) . . ?
C16 H161a 1.989(4) . . ?
C16 H161b 1.990(4) . . ?
C16 H161c 2.236(5) . . ?
N21 N22 2.275(4) . . ?
N21 C23 2.366(6) . . ?
N21 C24 2.716(7) . . ?
N21 C25 2.357(7) . . ?
N21 C261 2.400(5) . . ?
N21 H261b 2.481(3) . . ?
C22 Si2 2.740(4) . . ?
C22 C24 2.386(7) . . ?
C22 C25 2.747(7) . . ?
C22 C26 2.336(5) . . ?
C22 H23 2.128(4) . . ?
C22 H323b 2.617(3) . . ?
N22 C222 2.986(6) . . ?
N22 C223 2.978(6) . . ?
N22 C23 2.495(7) . . ?
N22 H323b 2.532(4) . . ?
Si2 H221a 2.390(3) . . ?
Si2 H221b 2.396(3) . . ?
Si2 H221c 2.4233(18) . . ?
Si2 H222a 2.365(3) . . ?
Si2 H222b 2.358(2) . . ?
Si2 H222c 2.380(2) . . ?
Si2 H223a 2.307(2) . . ?
Si2 H223b 2.309(2) . . ?
Si2 H223c 2.3406(17) . . ?
C221 C223 2.962(10) . . ?
C23 C25 2.385(6) . . ?
C23 C26 2.721(6) . . ?
C23 H24 2.002(5) . . ?
C24 C26 2.347(7) . . ?
C24 H23 2.027(5) . . ?
C24 H25 2.034(5) . . ?
C25 C261 2.504(7) . . ?
C25 H24 2.048(5) . . ?
C25 H261a 2.659(5) . . ?
C26 H25 2.012(5) . . ?
C26 H261a 2.048(4) . . ?
C26 H261b 2.042(4) . . ?
C26 H261c 2.084(4) . . ?
C261 H25 2.682(6) . . ?
Si3 C32 2.720(4) . . ?
Si3 H321a 2.402(3) . . ?
Si3 H321b 2.398(2) . . ?
Si3 H321c 2.4057(19) . . ?
Si3 H322a 2.3731(18) . . ?
Si3 H322b 2.3728(17) . . ?
Si3 H322c 2.414(3) . . ?
Si3 H323a 2.3288(14) . . ?
Si3 H323b 2.332(2) . . ?
Si3 H323c 2.3815(16) . . ?
N31 N32 2.286(4) . . ?
N31 C33 2.375(5) . . ?
N31 C34 2.725(5) . . ?
N31 C35 2.370(5) . . ?
N31 C361 2.406(5) . . ?
N31 H361c 2.497(4) . . ?
C32 C34 2.391(5) . . ?
C32 C35 2.766(5) . . ?
C32 C36 2.346(5) . . ?
C32 H123b 2.560(4) . . ?
C32 H33 2.081(4) . . ?
N32 C321 2.994(5) . . ?
N32 C323 2.993(6) . . ?
N32 C33 2.490(5) . . ?
N32 H123b 2.540(4) . . ?
C321 C323 2.959(8) . . ?
C322 C323 2.972(8) . . ?
C33 C35 2.386(6) . . ?
C33 C36 2.729(6) . . ?
C33 H34 2.041(4) . . ?
C34 C36 2.369(5) . . ?
C34 H33 2.055(4) . . ?
C34 H35 2.061(4) . . ?
C35 C361 2.530(6) . . ?
C35 H34 2.027(4) . . ?
C36 H35 2.068(4) . . ?
C36 H361a 2.080(3) . . ?
C36 H361b 2.066(5) . . ?
C36 H361c 2.061(4) . . ?
H121a H121b 1.551(2) . . ?
H121a H121c 1.5495(12) . . ?
H121a H13 2.0735(11) . . ?
H121b H121c 1.5495(12) . . ?
H122a H122b 1.5514(16) . . ?
H122a H122c 1.5488(7) . . ?
H122b H122c 1.5488(12) . . ?
H122b H13 2.3703(14) . . ?
H123a H123b 1.5514(6) . . ?
H123a H123c 1.5436(12) . . ?
H123b H123c 1.5437(7) . . ?
H13 H14 2.339(2) . . ?
H14 H15 2.3255(19) . . ?
H161a H161b 1.5513(6) . . ?
H161a H161c 1.658(3) . . ?
H161a H33 2.347(2) . 1_544 ?
H161b H161c 1.6583(14) . . ?
H161c H222a 2.3684(10) . . ?
H161c H361a 2.352(2) . 2 ?
H221a H221b 1.5513(14) . . ?
H221a H221c 1.5472(7) . . ?
H221a H23 2.1017(9) . . ?
H221b H221c 1.5472(9) . . ?
H222a H222b 1.5513(16) . . ?
H222a H222c 1.5489(7) . . ?
H222b H222c 1.5488(6) . . ?
H223a H223b 1.551(2) . . ?
H223a H223c 1.5461(10) . . ?
H223b H223c 1.5462(6) . . ?
H23 H24 2.2682(10) . . ?
H24 H25 2.3695(9) . . ?
H261a H261a 2.392(3) . 2_565 ?
H261a H261b 1.5513(10) . . ?
H261a H261c 1.516(2) . . ?
H261b H261c 1.5165(10) . . ?
H321a H321b 1.5514(6) . . ?
H321a H321c 1.5512(10) . . ?
H321a H33 2.1206(9) . . ?
H321b H321c 1.551(2) . . ?
H322a H322b 1.5513(13) . . ?
H322a H322c 1.5452(13) . . ?
H322b H322c 1.5453(10) . . ?
H322b H33 2.2776(18) . . ?
H323a H323b 1.5513(10) . . ?
H323a H323c 1.544(2) . . ?
H323b H323c 1.5440(13) . . ?
H33 H34 2.3884(11) . . ?
H34 H35 2.331(3) . . ?
H361a H361b 1.6737(12) . . ?
H361a H361c 1.6738(7) . . ?
H361b H361b 2.2409(19) . 2_556 ?
H361b H361c 1.5513(9) . . ?
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
? ? ? ? ? ? ? ? ? ?
loop_
_reflns_scale_group_code
_reflns_scale_meas_F
? .63541
