#------------------------------------------------------------------------------
#$Date: 2021-01-07 07:24:41 +0100 (jue 07 de ene de 2021) $
#$Revision: 260770 $
#$URL: svn://www.crystallography.net/cod/cif/7/70/57/7705749.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_7705749
loop_
_publ_author_name
'Guzmán, Jefferson'
'Bernal, Ana M.'
'García-Orduña, Pilar'
'Lahoz, Fernando J.'
'Polo, Víctor'
'Fernández-Alvarez, Francisco J'
_publ_section_title
;
 2-Pyridone-stabilized iridium silylene/silyl complexes: structure and
 QTAIM analysis.
;
_journal_issue                   48
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              17665
_journal_page_last               17673
_journal_paper_doi               10.1039/d0dt03326j
_journal_volume                  49
_journal_year                    2020
_chemical_formula_moiety         'C24 H40 Cl Ir N2 O2 Si2'
_chemical_formula_sum            'C24 H40 Cl Ir N2 O2 Si2'
_chemical_formula_weight         672.41
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2018/3
_audit_update_record
;
2020-03-12 deposited with the CCDC.	2020-11-19 downloaded from the CCDC.
;
_cell_angle_alpha                105.4291(7)
_cell_angle_beta                 103.4935(6)
_cell_angle_gamma                94.0182(6)
_cell_formula_units_Z            4
_cell_length_a                   12.0235(6)
_cell_length_b                   14.4027(7)
_cell_length_c                   17.5331(8)
_cell_measurement_reflns_used    9812
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      30.082
_cell_measurement_theta_min      2.198
_cell_volume                     2817.6(2)
_computing_cell_refinement
'SAINT+ in APEX3 v. 2017.3 (Bruker AXS, 2008)'
_computing_data_collection       'SMART in APEX2 v. 2008.4 (Bruker AXS, 2008)'
_computing_data_reduction
'SAINT+ in APEX3 v. 2017.3 (Bruker AXS, 2008)'
_computing_molecular_graphics    'ORTEP-3 (Farrugia, 2012)'
_computing_publication_material  'XCIF program, PLATON(Spek, 1998)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_structure_solution    'SHELXS-2013 (Sheldrick, 2013)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 8.26
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.939
_diffrn_measurement_device_type  'Bruker APEX DUO system'
_diffrn_measurement_method       'narrow ω frames'
_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  0.0240
_diffrn_reflns_av_unetI/netI     0.0212
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.939
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            64840
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.939
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         30.198
_diffrn_reflns_theta_min         1.248
_exptl_absorpt_coefficient_mu    4.941
_exptl_absorpt_correction_T_max  0.5567
_exptl_absorpt_correction_T_min  0.4155
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
 SADABS 2016/2: Krause, L., Herbst-Irmer, R., Sheldrick G.M. & Stalke D.,
 J. Appl. Cryst. 48 (2015) 3-10
;
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.585
_exptl_crystal_description       prism
_exptl_crystal_F_000             1344
_exptl_crystal_recrystallization_method
'Re-crystallisation from solvent: dichloromethane'
_exptl_crystal_size_max          0.203
_exptl_crystal_size_mid          0.197
_exptl_crystal_size_min          0.103
_refine_diff_density_max         3.258
_refine_diff_density_min         -1.680
_refine_diff_density_rms         0.135
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.034
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     596
_refine_ls_number_reflns         15705
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.034
_refine_ls_R_factor_all          0.0301
_refine_ls_R_factor_gt           0.0247
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0434P)²+1.1552P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0627
_refine_ls_wR_factor_ref         0.0655
_reflns_Friedel_coverage         0.000
_reflns_number_gt                13872
_reflns_number_total             15705
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d0dt03326j2.cif
_cod_data_source_block           cmpnd_3
_cod_depositor_comments
'Adding full bibliography for 7705749--7705751.cif.'
_cod_database_code               7705749
_shelx_shelxl_version_number     2018/3
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ir1 Ir 0.13128(2) 0.88510(2) 0.30526(2) 0.01101(3) Uani 1 1 d . . . . .
Cl1 Cl 0.15318(5) 1.06155(4) 0.33719(4) 0.01842(12) Uani 1 1 d . . . . .
Si1 Si 0.11658(6) 0.75530(5) 0.35445(4) 0.01237(12) Uani 1 1 d . . . . .
Si2 Si 0.11405(6) 0.77949(5) 0.18138(4) 0.01402(12) Uani 1 1 d . . . . .
N1 N 0.30476(18) 0.88450(15) 0.35478(12) 0.0127(4) Uani 1 1 d . . . . .
N2 N -0.04374(18) 0.87493(15) 0.25656(13) 0.0149(4) Uani 1 1 d . . . . .
O1 O 0.25906(14) 0.73506(12) 0.37443(11) 0.0152(3) Uani 1 1 d . . . . .
O2 O -0.03401(15) 0.74295(13) 0.15020(11) 0.0177(4) Uani 1 1 d . . . . .
C1 C 0.3387(2) 0.80756(17) 0.38071(14) 0.0131(4) Uani 1 1 d . . . . .
C2 C 0.4548(2) 0.80132(18) 0.41325(15) 0.0151(4) Uani 1 1 d . . . . .
H2 H 0.474938 0.746991 0.431825 0.018 Uiso 1 1 calc R U . . .
C3 C 0.5406(2) 0.87407(18) 0.41853(15) 0.0152(5) Uani 1 1 d . . . . .
C4 C 0.5054(2) 0.95307(18) 0.39124(15) 0.0160(5) Uani 1 1 d . . . . .
H4 H 0.561367 1.004570 0.393889 0.019 Uiso 1 1 calc R U . . .
C5 C 0.3906(2) 0.95607(18) 0.36084(15) 0.0154(5) Uani 1 1 d . . . . .
H5 H 0.369200 1.010581 0.342961 0.019 Uiso 1 1 calc R U . . .
C6 C 0.6660(2) 0.8674(2) 0.45198(17) 0.0214(5) Uani 1 1 d . . . . .
H6A H 0.697252 0.918637 0.503982 0.032 Uiso 1 1 calc R U . . .
H6B H 0.709053 0.875591 0.412607 0.032 Uiso 1 1 calc R U . . .
H6C H 0.673275 0.803629 0.461142 0.032 Uiso 1 1 calc R U . . .
C7 C 0.0309(2) 0.62970(18) 0.29963(15) 0.0164(5) Uani 1 1 d . . . . .
H7 H 0.022324 0.617798 0.239570 0.020 Uiso 1 1 calc R U . . .
C8 C 0.0950(2) 0.55009(19) 0.32585(18) 0.0231(5) Uani 1 1 d . . . . .
H8A H 0.109747 0.562688 0.385325 0.035 Uiso 1 1 calc R U . . .
H8B H 0.168594 0.550270 0.310874 0.035 Uiso 1 1 calc R U . . .
H8C H 0.047571 0.486534 0.298064 0.035 Uiso 1 1 calc R U . . .
C9 C -0.0911(2) 0.6225(2) 0.31275(17) 0.0209(5) Uani 1 1 d . . . . .
H9A H -0.133244 0.557531 0.282151 0.031 Uiso 1 1 calc R U . . .
H9B H -0.132416 0.671532 0.293200 0.031 Uiso 1 1 calc R U . . .
H9C H -0.085461 0.633982 0.371273 0.031 Uiso 1 1 calc R U . . .
C10 C 0.0924(2) 0.79651(18) 0.46157(15) 0.0172(5) Uani 1 1 d . . . . .
H10 H 0.083295 0.737238 0.480233 0.021 Uiso 1 1 calc R U . . .
C11 C -0.0171(3) 0.8451(2) 0.46434(18) 0.0259(6) Uani 1 1 d . . . . .
H11A H -0.030191 0.856213 0.518988 0.039 Uiso 1 1 calc R U . . .
H11B H -0.083676 0.802675 0.423309 0.039 Uiso 1 1 calc R U . . .
H11C H -0.007306 0.907535 0.452493 0.039 Uiso 1 1 calc R U . . .
C12 C 0.1967(2) 0.8657(2) 0.52334(16) 0.0233(5) Uani 1 1 d . . . . .
H12A H 0.207838 0.924832 0.506859 0.035 Uiso 1 1 calc R U . . .
H12B H 0.266009 0.833522 0.524632 0.035 Uiso 1 1 calc R U . . .
H12C H 0.182859 0.882841 0.577972 0.035 Uiso 1 1 calc R U . . .
C13 C -0.0985(2) 0.79945(18) 0.18944(15) 0.0168(5) Uani 1 1 d . . . . .
C14 C -0.2185(2) 0.7789(2) 0.16291(17) 0.0200(5) Uani 1 1 d . . . . .
H14 H -0.254158 0.724799 0.116731 0.024 Uiso 1 1 calc R U . . .
C15 C -0.2863(2) 0.8375(2) 0.20381(17) 0.0200(5) Uani 1 1 d . . . . .
C16 C -0.2293(2) 0.9188(2) 0.26958(17) 0.0199(5) Uani 1 1 d . . . . .
H16 H -0.272620 0.962553 0.297112 0.024 Uiso 1 1 calc R U . . .
C17 C -0.1103(2) 0.93492(19) 0.29402(16) 0.0173(5) Uani 1 1 d . . . . .
H17 H -0.073095 0.990093 0.338820 0.021 Uiso 1 1 calc R U . . .
C18 C -0.4151(2) 0.8142(2) 0.18118(19) 0.0274(6) Uani 1 1 d . . . . .
H18A H -0.440649 0.759022 0.131349 0.041 Uiso 1 1 calc R U . . .
H18B H -0.449767 0.870940 0.171327 0.041 Uiso 1 1 calc R U . . .
H18C H -0.439338 0.797410 0.226052 0.041 Uiso 1 1 calc R U . . .
C19 C 0.1811(2) 0.66354(18) 0.15833(15) 0.0166(5) Uani 1 1 d . . . . .
H19 H 0.183748 0.635143 0.204829 0.020 Uiso 1 1 calc R U . . .
C20 C 0.3056(2) 0.6843(2) 0.15318(18) 0.0233(5) Uani 1 1 d . . . . .
H20A H 0.339603 0.623675 0.144430 0.035 Uiso 1 1 calc R U . . .
H20B H 0.351195 0.731248 0.204451 0.035 Uiso 1 1 calc R U . . .
H20C H 0.305620 0.711179 0.107384 0.035 Uiso 1 1 calc R U . . .
C21 C 0.1086(3) 0.5873(2) 0.07933(17) 0.0266(6) Uani 1 1 d . . . . .
H21A H 0.101708 0.614289 0.032929 0.040 Uiso 1 1 calc R U . . .
H21B H 0.031472 0.570420 0.085517 0.040 Uiso 1 1 calc R U . . .
H21C H 0.146510 0.528862 0.069312 0.040 Uiso 1 1 calc R U . . .
C22 C 0.1425(2) 0.8525(2) 0.11016(16) 0.0205(5) Uani 1 1 d . . . . .
H22 H 0.147492 0.805003 0.058219 0.025 Uiso 1 1 calc R U . . .
C23 C 0.2579(3) 0.9212(2) 0.14562(17) 0.0267(6) Uani 1 1 d . . . . .
H23A H 0.270309 0.954743 0.105842 0.040 Uiso 1 1 calc R U . . .
H23B H 0.321106 0.883388 0.157126 0.040 Uiso 1 1 calc R U . . .
H23C H 0.255604 0.969219 0.196497 0.040 Uiso 1 1 calc R U . . .
C24 C 0.0447(3) 0.9109(2) 0.08758(18) 0.0299(6) Uani 1 1 d . . . . .
H24A H 0.034568 0.955701 0.137612 0.045 Uiso 1 1 calc R U . . .
H24B H -0.027193 0.866226 0.058801 0.045 Uiso 1 1 calc R U . . .
H24C H 0.063991 0.948014 0.051896 0.045 Uiso 1 1 calc R U . . .
Ir31 Ir 0.43438(2) 0.75223(2) 0.76099(2) 0.01220(3) Uani 1 1 d . . . . .
Cl31 Cl 0.45354(6) 0.91357(5) 0.74499(5) 0.02725(15) Uani 1 1 d . . . . .
Si31 Si 0.42851(6) 0.69570(5) 0.86819(4) 0.01492(13) Uani 1 1 d . . . . .
Si32 Si 0.41806(6) 0.59581(5) 0.68541(4) 0.01344(12) Uani 1 1 d . . . . .
O31 O 0.56968(15) 0.67302(14) 0.89646(11) 0.0196(4) Uani 1 1 d . . . . .
O32 O 0.26935(15) 0.56477(13) 0.65763(11) 0.0165(3) Uani 1 1 d . . . . .
N31 N 0.60888(19) 0.76342(16) 0.81258(13) 0.0159(4) Uani 1 1 d . . . . .
N32 N 0.25913(18) 0.72876(15) 0.70719(13) 0.0148(4) Uani 1 1 d . . . . .
C31 C 0.6469(2) 0.71578(19) 0.86853(16) 0.0184(5) Uani 1 1 d . . . . .
C32 C 0.7638(2) 0.7071(2) 0.89518(17) 0.0223(5) Uani 1 1 d . . . . .
H32 H 0.787862 0.673031 0.934333 0.027 Uiso 1 1 calc R U . . .
C33 C 0.8445(2) 0.7484(2) 0.86433(18) 0.0240(6) Uani 1 1 d . . . . .
C34 C 0.8056(2) 0.8019(2) 0.80973(17) 0.0228(5) Uani 1 1 d . . . . .
H34 H 0.858969 0.833586 0.789307 0.027 Uiso 1 1 calc R U . . .
C35 C 0.6899(2) 0.80828(19) 0.78584(16) 0.0187(5) Uani 1 1 d . . . . .
H35 H 0.665094 0.845383 0.749213 0.022 Uiso 1 1 calc R U . . .
C36 C 0.9697(2) 0.7348(3) 0.8865(2) 0.0343(7) Uani 1 1 d . . . . .
H36A H 0.982288 0.698532 0.927110 0.051 Uiso 1 1 calc R U . . .
H36B H 1.017915 0.798544 0.909662 0.051 Uiso 1 1 calc R U . . .
H36C H 0.990554 0.698462 0.837309 0.051 Uiso 1 1 calc R U . . .
C37 C 0.3335(2) 0.58470(19) 0.86782(16) 0.0189(5) Uani 1 1 d . . . . .
H37 H 0.324583 0.534098 0.814356 0.023 Uiso 1 1 calc R U . . .
C38 C 0.3892(3) 0.5417(2) 0.93653(19) 0.0297(6) Uani 1 1 d . . . . .
H38A H 0.402895 0.591036 0.989715 0.045 Uiso 1 1 calc R U . . .
H38B H 0.462911 0.521534 0.928635 0.045 Uiso 1 1 calc R U . . .
H38C H 0.337459 0.485272 0.935071 0.045 Uiso 1 1 calc R U . . .
C39 C 0.2124(2) 0.6078(2) 0.87349(18) 0.0245(6) Uani 1 1 d . . . . .
H39A H 0.164430 0.548541 0.870813 0.037 Uiso 1 1 calc R U . . .
H39B H 0.177062 0.632334 0.827780 0.037 Uiso 1 1 calc R U . . .
H39C H 0.218421 0.657271 0.925488 0.037 Uiso 1 1 calc R U . . .
C40 C 0.4183(2) 0.8026(2) 0.95668(16) 0.0213(5) Uani 1 1 d . . . . .
H40 H 0.401221 0.775546 1.000310 0.026 Uiso 1 1 calc R U . . .
C41 C 0.3200(3) 0.8598(2) 0.93150(18) 0.0279(6) Uani 1 1 d . . . . .
H41A H 0.313392 0.909883 0.979919 0.042 Uiso 1 1 calc R U . . .
H41B H 0.247197 0.815347 0.907307 0.042 Uiso 1 1 calc R U . . .
H41C H 0.336686 0.890832 0.891187 0.042 Uiso 1 1 calc R U . . .
C42 C 0.5325(3) 0.8723(2) 0.99452(18) 0.0285(6) Uani 1 1 d . . . . .
H42A H 0.550730 0.901240 0.953486 0.043 Uiso 1 1 calc R U . . .
H42B H 0.594610 0.836121 1.012537 0.043 Uiso 1 1 calc R U . . .
H42C H 0.525015 0.923830 1.041662 0.043 Uiso 1 1 calc R U . . .
C43 C 0.2062(2) 0.63719(18) 0.66322(15) 0.0150(4) Uani 1 1 d . . . . .
C44 C 0.0881(2) 0.61725(19) 0.62419(17) 0.0191(5) Uani 1 1 d . . . . .
H44 H 0.054804 0.552805 0.592220 0.023 Uiso 1 1 calc R U . . .
C45 C 0.0195(2) 0.6902(2) 0.63162(17) 0.0201(5) Uani 1 1 d . . . . .
C46 C 0.0740(2) 0.7844(2) 0.67938(17) 0.0202(5) Uani 1 1 d . . . . .
H46 H 0.029785 0.836616 0.687319 0.024 Uiso 1 1 calc R U . . .
C47 C 0.1905(2) 0.80052(18) 0.71433(16) 0.0171(5) Uani 1 1 d . . . . .
H47 H 0.225519 0.864954 0.745134 0.021 Uiso 1 1 calc R U . . .
C48 C -0.1076(2) 0.6703(2) 0.5905(2) 0.0312(7) Uani 1 1 d . . . . .
H48A H -0.141325 0.730790 0.602886 0.047 Uiso 1 1 calc R U . . .
H48B H -0.119745 0.644534 0.531081 0.047 Uiso 1 1 calc R U . . .
H48C H -0.144881 0.622489 0.610717 0.047 Uiso 1 1 calc R U . . .
C49 C 0.4787(2) 0.49091(19) 0.71877(16) 0.0179(5) Uani 1 1 d . . . . .
H49 H 0.481678 0.502587 0.778079 0.021 Uiso 1 1 calc R U . . .
C50 C 0.6028(2) 0.4847(2) 0.70952(18) 0.0238(6) Uani 1 1 d . . . . .
H50A H 0.631505 0.429378 0.726638 0.036 Uiso 1 1 calc R U . . .
H50B H 0.653145 0.544883 0.743964 0.036 Uiso 1 1 calc R U . . .
H50C H 0.602557 0.475753 0.652079 0.036 Uiso 1 1 calc R U . . .
C51 C 0.4007(2) 0.39424(19) 0.67055(19) 0.0243(6) Uani 1 1 d . . . . .
H51A H 0.393128 0.382967 0.611815 0.036 Uiso 1 1 calc R U . . .
H51B H 0.324257 0.396968 0.681026 0.036 Uiso 1 1 calc R U . . .
H51C H 0.434921 0.341035 0.688021 0.036 Uiso 1 1 calc R U . . .
C52 C 0.4507(2) 0.59155(19) 0.58336(15) 0.0185(5) Uani 1 1 d . . . . .
H52 H 0.459262 0.522701 0.557031 0.022 Uiso 1 1 calc R U . . .
C53 C 0.5637(3) 0.6548(2) 0.59210(18) 0.0291(6) Uani 1 1 d . . . . .
H53A H 0.580952 0.642228 0.538623 0.044 Uiso 1 1 calc R U . . .
H53B H 0.626849 0.638962 0.631075 0.044 Uiso 1 1 calc R U . . .
H53C H 0.555536 0.723635 0.612184 0.044 Uiso 1 1 calc R U . . .
C54 C 0.3514(3) 0.6187(2) 0.52488(17) 0.0293(6) Uani 1 1 d . . . . .
H54A H 0.337760 0.684861 0.549940 0.044 Uiso 1 1 calc R U . . .
H54B H 0.281268 0.572996 0.513924 0.044 Uiso 1 1 calc R U . . .
H54C H 0.371467 0.615668 0.473304 0.044 Uiso 1 1 calc R U . . .
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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ir Ir -1.4442 7.9887 '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'
O O 0.0106 0.0060 '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
N2 Ir1 N1 175.56(8) . . ?
N2 Ir1 Si2 80.69(6) . . ?
N1 Ir1 Si2 97.88(6) . . ?
N2 Ir1 Si1 94.56(6) . . ?
N1 Ir1 Si1 81.17(6) . . ?
Si2 Ir1 Si1 87.96(2) . . ?
N2 Ir1 Cl1 91.15(6) . . ?
N1 Ir1 Cl1 93.07(6) . . ?
Si2 Ir1 Cl1 125.97(2) . . ?
Si1 Ir1 Cl1 146.07(2) . . ?
O1 Si1 C7 104.40(10) . . ?
O1 Si1 C10 102.73(10) . . ?
C7 Si1 C10 108.15(11) . . ?
O1 Si1 Ir1 99.93(6) . . ?
C7 Si1 Ir1 128.46(8) . . ?
C10 Si1 Ir1 109.74(8) . . ?
O2 Si2 C19 105.53(10) . . ?
O2 Si2 C22 104.61(11) . . ?
C19 Si2 C22 108.90(12) . . ?
O2 Si2 Ir1 100.42(6) . . ?
C19 Si2 Ir1 127.17(8) . . ?
C22 Si2 Ir1 107.79(9) . . ?
C1 N1 C5 116.6(2) . . ?
C1 N1 Ir1 119.23(16) . . ?
C5 N1 Ir1 124.10(16) . . ?
C13 N2 C17 117.7(2) . . ?
C13 N2 Ir1 119.52(17) . . ?
C17 N2 Ir1 122.35(17) . . ?
C1 O1 Si1 117.39(15) . . ?
C13 O2 Si2 117.04(16) . . ?
O1 C1 N1 119.1(2) . . ?
O1 C1 C2 118.6(2) . . ?
N1 C1 C2 122.3(2) . . ?
C3 C2 C1 120.3(2) . . ?
C3 C2 H2 119.8 . . ?
C1 C2 H2 119.8 . . ?
C2 C3 C4 117.2(2) . . ?
C2 C3 C6 120.9(2) . . ?
C4 C3 C6 121.9(2) . . ?
C5 C4 C3 120.1(2) . . ?
C5 C4 H4 120.0 . . ?
C3 C4 H4 120.0 . . ?
C4 C5 N1 123.4(2) . . ?
C4 C5 H5 118.3 . . ?
N1 C5 H5 118.3 . . ?
C3 C6 H6A 109.5 . . ?
C3 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
C3 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C8 C7 C9 110.3(2) . . ?
C8 C7 Si1 111.38(18) . . ?
C9 C7 Si1 112.01(17) . . ?
C8 C7 H7 107.6 . . ?
C9 C7 H7 107.6 . . ?
Si1 C7 H7 107.6 . . ?
C7 C8 H8A 109.5 . . ?
C7 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C7 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C7 C9 H9A 109.5 . . ?
C7 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C7 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C12 C10 C11 109.0(2) . . ?
C12 C10 Si1 111.68(17) . . ?
C11 C10 Si1 113.71(18) . . ?
C12 C10 H10 107.4 . . ?
C11 C10 H10 107.4 . . ?
Si1 C10 H10 107.4 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
O2 C13 N2 118.2(2) . . ?
O2 C13 C14 119.9(2) . . ?
N2 C13 C14 121.8(2) . . ?
C15 C14 C13 120.2(2) . . ?
C15 C14 H14 119.9 . . ?
C13 C14 H14 119.9 . . ?
C14 C15 C16 117.6(2) . . ?
C14 C15 C18 122.1(3) . . ?
C16 C15 C18 120.3(2) . . ?
C17 C16 C15 119.7(2) . . ?
C17 C16 H16 120.1 . . ?
C15 C16 H16 120.1 . . ?
N2 C17 C16 122.7(2) . . ?
N2 C17 H17 118.7 . . ?
C16 C17 H17 118.7 . . ?
C15 C18 H18A 109.5 . . ?
C15 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C15 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C20 C19 C21 110.4(2) . . ?
C20 C19 Si2 111.26(18) . . ?
C21 C19 Si2 112.02(18) . . ?
C20 C19 H19 107.6 . . ?
C21 C19 H19 107.6 . . ?
Si2 C19 H19 107.6 . . ?
C19 C20 H20A 109.5 . . ?
C19 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C19 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C19 C21 H21A 109.5 . . ?
C19 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C19 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C24 C22 C23 109.4(2) . . ?
C24 C22 Si2 112.57(19) . . ?
C23 C22 Si2 112.51(18) . . ?
C24 C22 H22 107.4 . . ?
C23 C22 H22 107.4 . . ?
Si2 C22 H22 107.4 . . ?
C22 C23 H23A 109.5 . . ?
C22 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C22 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C22 C24 H24A 109.5 . . ?
C22 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C22 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
N31 Ir31 N32 175.28(8) . . ?
N31 Ir31 Si31 80.67(6) . . ?
N32 Ir31 Si31 97.40(6) . . ?
N31 Ir31 Si32 94.33(6) . . ?
N32 Ir31 Si32 81.24(6) . . ?
Si31 Ir31 Si32 87.31(2) . . ?
N31 Ir31 Cl31 92.29(6) . . ?
N32 Ir31 Cl31 92.16(6) . . ?
Si31 Ir31 Cl31 133.44(3) . . ?
Si32 Ir31 Cl31 139.25(3) . . ?
O31 Si31 C37 106.08(11) . . ?
O31 Si31 C40 103.97(11) . . ?
C37 Si31 C40 108.47(12) . . ?
O31 Si31 Ir31 100.44(7) . . ?
C37 Si31 Ir31 127.45(9) . . ?
C40 Si31 Ir31 107.86(9) . . ?
O32 Si32 C49 105.57(10) . . ?
O32 Si32 C52 102.61(10) . . ?
C49 Si32 C52 107.44(11) . . ?
O32 Si32 Ir31 100.17(6) . . ?
C49 Si32 Ir31 128.33(9) . . ?
C52 Si32 Ir31 109.53(8) . . ?
C31 O31 Si31 116.87(16) . . ?
C43 O32 Si32 117.19(16) . . ?
C31 N31 C35 117.6(2) . . ?
C31 N31 Ir31 119.64(17) . . ?
C35 N31 Ir31 122.34(17) . . ?
C43 N32 C47 116.9(2) . . ?
C43 N32 Ir31 119.58(16) . . ?
C47 N32 Ir31 123.54(18) . . ?
O31 C31 N31 118.6(2) . . ?
O31 C31 C32 119.4(2) . . ?
N31 C31 C32 122.0(2) . . ?
C33 C32 C31 119.9(3) . . ?
C33 C32 H32 120.1 . . ?
C31 C32 H32 120.1 . . ?
C32 C33 C34 117.9(2) . . ?
C32 C33 C36 121.7(3) . . ?
C34 C33 C36 120.4(3) . . ?
C35 C34 C33 119.8(3) . . ?
C35 C34 H34 120.1 . . ?
C33 C34 H34 120.1 . . ?
N31 C35 C34 122.7(2) . . ?
N31 C35 H35 118.6 . . ?
C34 C35 H35 118.6 . . ?
C33 C36 H36A 109.5 . . ?
C33 C36 H36B 109.5 . . ?
H36A C36 H36B 109.5 . . ?
C33 C36 H36C 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
C39 C37 C38 110.8(2) . . ?
C39 C37 Si31 111.37(18) . . ?
C38 C37 Si31 111.65(19) . . ?
C39 C37 H37 107.6 . . ?
C38 C37 H37 107.6 . . ?
Si31 C37 H37 107.6 . . ?
C37 C38 H38A 109.5 . . ?
C37 C38 H38B 109.5 . . ?
H38A C38 H38B 109.5 . . ?
C37 C38 H38C 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
C37 C39 H39A 109.5 . . ?
C37 C39 H39B 109.5 . . ?
H39A C39 H39B 109.5 . . ?
C37 C39 H39C 109.5 . . ?
H39A C39 H39C 109.5 . . ?
H39B C39 H39C 109.5 . . ?
C41 C40 C42 109.5(2) . . ?
C41 C40 Si31 112.49(19) . . ?
C42 C40 Si31 112.06(19) . . ?
C41 C40 H40 107.5 . . ?
C42 C40 H40 107.5 . . ?
Si31 C40 H40 107.5 . . ?
C40 C41 H41A 109.5 . . ?
C40 C41 H41B 109.5 . . ?
H41A C41 H41B 109.5 . . ?
C40 C41 H41C 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?
C40 C42 H42A 109.5 . . ?
C40 C42 H42B 109.5 . . ?
H42A C42 H42B 109.5 . . ?
C40 C42 H42C 109.5 . . ?
H42A C42 H42C 109.5 . . ?
H42B C42 H42C 109.5 . . ?
O32 C43 N32 118.6(2) . . ?
O32 C43 C44 119.3(2) . . ?
N32 C43 C44 122.1(2) . . ?
C45 C44 C43 120.6(2) . . ?
C45 C44 H44 119.7 . . ?
C43 C44 H44 119.7 . . ?
C44 C45 C46 117.1(2) . . ?
C44 C45 C48 121.5(3) . . ?
C46 C45 C48 121.4(2) . . ?
C47 C46 C45 119.9(2) . . ?
C47 C46 H46 120.0 . . ?
C45 C46 H46 120.0 . . ?
N32 C47 C46 123.3(2) . . ?
N32 C47 H47 118.3 . . ?
C46 C47 H47 118.3 . . ?
C45 C48 H48A 109.5 . . ?
C45 C48 H48B 109.5 . . ?
H48A C48 H48B 109.5 . . ?
C45 C48 H48C 109.5 . . ?
H48A C48 H48C 109.5 . . ?
H48B C48 H48C 109.5 . . ?
C51 C49 C50 110.2(2) . . ?
C51 C49 Si32 111.10(18) . . ?
C50 C49 Si32 111.38(18) . . ?
C51 C49 H49 108.0 . . ?
C50 C49 H49 108.0 . . ?
Si32 C49 H49 108.0 . . ?
C49 C50 H50A 109.5 . . ?
C49 C50 H50B 109.5 . . ?
H50A C50 H50B 109.5 . . ?
C49 C50 H50C 109.5 . . ?
H50A C50 H50C 109.5 . . ?
H50B C50 H50C 109.5 . . ?
C49 C51 H51A 109.5 . . ?
C49 C51 H51B 109.5 . . ?
H51A C51 H51B 109.5 . . ?
C49 C51 H51C 109.5 . . ?
H51A C51 H51C 109.5 . . ?
H51B C51 H51C 109.5 . . ?
C54 C52 C53 109.5(2) . . ?
C54 C52 Si32 111.99(18) . . ?
C53 C52 Si32 113.66(18) . . ?
C54 C52 H52 107.1 . . ?
C53 C52 H52 107.1 . . ?
Si32 C52 H52 107.1 . . ?
C52 C53 H53A 109.5 . . ?
C52 C53 H53B 109.5 . . ?
H53A C53 H53B 109.5 . . ?
C52 C53 H53C 109.5 . . ?
H53A C53 H53C 109.5 . . ?
H53B C53 H53C 109.5 . . ?
C52 C54 H54A 109.5 . . ?
C52 C54 H54B 109.5 . . ?
H54A C54 H54B 109.5 . . ?
C52 C54 H54C 109.5 . . ?
H54A C54 H54C 109.5 . . ?
H54B C54 H54C 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
Ir1 N2 2.057(2) . ?
Ir1 N1 2.065(2) . ?
Ir1 Si2 2.2499(7) . ?
Ir1 Si1 2.2700(7) . ?
Ir1 Cl1 2.4335(6) . ?
Si1 O1 1.7282(18) . ?
Si1 C7 1.900(3) . ?
Si1 C10 1.911(2) . ?
Si2 O2 1.7338(18) . ?
Si2 C19 1.893(3) . ?
Si2 C22 1.905(3) . ?
N1 C1 1.359(3) . ?
N1 C5 1.372(3) . ?
N2 C13 1.363(3) . ?
N2 C17 1.363(3) . ?
O1 C1 1.330(3) . ?
O2 C13 1.333(3) . ?
C1 C2 1.398(3) . ?
C2 C3 1.387(3) . ?
C2 H2 0.9500 . ?
C3 C4 1.402(3) . ?
C3 C6 1.504(3) . ?
C4 C5 1.367(3) . ?
C4 H4 0.9500 . ?
C5 H5 0.9500 . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C6 H6C 0.9800 . ?
C7 C8 1.536(4) . ?
C7 C9 1.537(3) . ?
C7 H7 1.0000 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 C12 1.535(4) . ?
C10 C11 1.539(4) . ?
C10 H10 1.0000 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 H12A 0.9800 . ?
C12 H12B 0.9800 . ?
C12 H12C 0.9800 . ?
C13 C14 1.392(3) . ?
C14 C15 1.392(4) . ?
C14 H14 0.9500 . ?
C15 C16 1.404(4) . ?
C15 C18 1.496(4) . ?
C16 C17 1.378(3) . ?
C16 H16 0.9500 . ?
C17 H17 0.9500 . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C19 C20 1.534(3) . ?
C19 C21 1.542(4) . ?
C19 H19 1.0000 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C22 C24 1.532(4) . ?
C22 C23 1.538(4) . ?
C22 H22 1.0000 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
Ir31 N31 2.058(2) . ?
Ir31 N32 2.061(2) . ?
Ir31 Si31 2.2515(7) . ?
Ir31 Si32 2.2579(7) . ?
Ir31 Cl31 2.4151(7) . ?
Si31 O31 1.7333(19) . ?
Si31 C37 1.896(3) . ?
Si31 C40 1.908(3) . ?
Si32 O32 1.7320(19) . ?
Si32 C49 1.893(3) . ?
Si32 C52 1.906(3) . ?
O31 C31 1.332(3) . ?
O32 C43 1.328(3) . ?
N31 C31 1.355(3) . ?
N31 C35 1.368(3) . ?
N32 C43 1.361(3) . ?
N32 C47 1.365(3) . ?
C31 C32 1.399(4) . ?
C32 C33 1.387(4) . ?
C32 H32 0.9500 . ?
C33 C34 1.401(4) . ?
C33 C36 1.505(4) . ?
C34 C35 1.373(4) . ?
C34 H34 0.9500 . ?
C35 H35 0.9500 . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
C37 C39 1.536(4) . ?
C37 C38 1.536(4) . ?
C37 H37 1.0000 . ?
C38 H38A 0.9800 . ?
C38 H38B 0.9800 . ?
C38 H38C 0.9800 . ?
C39 H39A 0.9800 . ?
C39 H39B 0.9800 . ?
C39 H39C 0.9800 . ?
C40 C41 1.535(4) . ?
C40 C42 1.536(4) . ?
C40 H40 1.0000 . ?
C41 H41A 0.9800 . ?
C41 H41B 0.9800 . ?
C41 H41C 0.9800 . ?
C42 H42A 0.9800 . ?
C42 H42B 0.9800 . ?
C42 H42C 0.9800 . ?
C43 C44 1.397(3) . ?
C44 C45 1.379(4) . ?
C44 H44 0.9500 . ?
C45 C46 1.408(4) . ?
C45 C48 1.501(4) . ?
C46 C47 1.368(4) . ?
C46 H46 0.9500 . ?
C47 H47 0.9500 . ?
C48 H48A 0.9800 . ?
C48 H48B 0.9800 . ?
C48 H48C 0.9800 . ?
C49 C51 1.534(4) . ?
C49 C50 1.544(4) . ?
C49 H49 1.0000 . ?
C50 H50A 0.9800 . ?
C50 H50B 0.9800 . ?
C50 H50C 0.9800 . ?
C51 H51A 0.9800 . ?
C51 H51B 0.9800 . ?
C51 H51C 0.9800 . ?
C52 C54 1.529(4) . ?
C52 C53 1.535(4) . ?
C52 H52 1.0000 . ?
C53 H53A 0.9800 . ?
C53 H53B 0.9800 . ?
C53 H53C 0.9800 . ?
C54 H54A 0.9800 . ?
C54 H54B 0.9800 . ?
C54 H54C 0.9800 . ?
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
C7 Si1 O1 C1 152.91(17) . . . . ?
C10 Si1 O1 C1 -94.28(18) . . . . ?
Ir1 Si1 O1 C1 18.74(17) . . . . ?
C19 Si2 O2 C13 151.41(18) . . . . ?
C22 Si2 O2 C13 -93.76(19) . . . . ?
Ir1 Si2 O2 C13 17.89(18) . . . . ?
Si1 O1 C1 N1 -13.6(3) . . . . ?
Si1 O1 C1 C2 166.92(17) . . . . ?
C5 N1 C1 O1 -178.5(2) . . . . ?
Ir1 N1 C1 O1 -0.8(3) . . . . ?
C5 N1 C1 C2 1.0(3) . . . . ?
Ir1 N1 C1 C2 178.64(18) . . . . ?
O1 C1 C2 C3 178.1(2) . . . . ?
N1 C1 C2 C3 -1.4(4) . . . . ?
C1 C2 C3 C4 0.9(4) . . . . ?
C1 C2 C3 C6 -178.9(2) . . . . ?
C2 C3 C4 C5 -0.2(4) . . . . ?
C6 C3 C4 C5 179.6(2) . . . . ?
C3 C4 C5 N1 -0.2(4) . . . . ?
C1 N1 C5 C4 -0.2(4) . . . . ?
Ir1 N1 C5 C4 -177.72(19) . . . . ?
O1 Si1 C7 C8 28.4(2) . . . . ?
C10 Si1 C7 C8 -80.5(2) . . . . ?
Ir1 Si1 C7 C8 143.94(15) . . . . ?
O1 Si1 C7 C9 152.51(18) . . . . ?
C10 Si1 C7 C9 43.6(2) . . . . ?
Ir1 Si1 C7 C9 -91.95(19) . . . . ?
Si2 O2 C13 N2 -7.3(3) . . . . ?
Si2 O2 C13 C14 174.49(19) . . . . ?
C17 N2 C13 O2 177.1(2) . . . . ?
Ir1 N2 C13 O2 -10.0(3) . . . . ?
C17 N2 C13 C14 -4.7(4) . . . . ?
Ir1 N2 C13 C14 168.19(19) . . . . ?
O2 C13 C14 C15 179.8(2) . . . . ?
N2 C13 C14 C15 1.6(4) . . . . ?
C13 C14 C15 C16 2.5(4) . . . . ?
C13 C14 C15 C18 -175.6(3) . . . . ?
C14 C15 C16 C17 -3.5(4) . . . . ?
C18 C15 C16 C17 174.7(2) . . . . ?
C13 N2 C17 C16 3.8(4) . . . . ?
Ir1 N2 C17 C16 -168.94(19) . . . . ?
C15 C16 C17 N2 0.3(4) . . . . ?
O2 Si2 C19 C20 159.56(17) . . . . ?
C22 Si2 C19 C20 47.7(2) . . . . ?
Ir1 Si2 C19 C20 -83.94(19) . . . . ?
O2 Si2 C19 C21 35.4(2) . . . . ?
C22 Si2 C19 C21 -76.4(2) . . . . ?
Ir1 Si2 C19 C21 151.90(15) . . . . ?
C37 Si31 O31 C31 151.86(19) . . . . ?
C40 Si31 O31 C31 -93.8(2) . . . . ?
Ir31 Si31 O31 C31 17.70(19) . . . . ?
C49 Si32 O32 C43 153.83(17) . . . . ?
C52 Si32 O32 C43 -93.76(18) . . . . ?
Ir31 Si32 O32 C43 19.08(17) . . . . ?
Si31 O31 C31 N31 -8.1(3) . . . . ?
Si31 O31 C31 C32 174.4(2) . . . . ?
C35 N31 C31 O31 178.9(2) . . . . ?
Ir31 N31 C31 O31 -8.5(3) . . . . ?
C35 N31 C31 C32 -3.6(4) . . . . ?
Ir31 N31 C31 C32 169.0(2) . . . . ?
O31 C31 C32 C33 177.7(2) . . . . ?
N31 C31 C32 C33 0.3(4) . . . . ?
C31 C32 C33 C34 3.0(4) . . . . ?
C31 C32 C33 C36 -175.5(3) . . . . ?
C32 C33 C34 C35 -2.8(4) . . . . ?
C36 C33 C34 C35 175.7(3) . . . . ?
C31 N31 C35 C34 3.9(4) . . . . ?
Ir31 N31 C35 C34 -168.6(2) . . . . ?
C33 C34 C35 N31 -0.6(4) . . . . ?
O31 Si31 C37 C39 160.21(18) . . . . ?
C40 Si31 C37 C39 49.0(2) . . . . ?
Ir31 Si31 C37 C39 -82.5(2) . . . . ?
O31 Si31 C37 C38 35.8(2) . . . . ?
C40 Si31 C37 C38 -75.4(2) . . . . ?
Ir31 Si31 C37 C38 153.09(16) . . . . ?
Si32 O32 C43 N32 -15.1(3) . . . . ?
Si32 O32 C43 C44 165.05(18) . . . . ?
C47 N32 C43 O32 -177.4(2) . . . . ?
Ir31 N32 C43 O32 1.3(3) . . . . ?
C47 N32 C43 C44 2.5(3) . . . . ?
Ir31 N32 C43 C44 -178.81(19) . . . . ?
O32 C43 C44 C45 177.4(2) . . . . ?
N32 C43 C44 C45 -2.5(4) . . . . ?
C43 C44 C45 C46 0.4(4) . . . . ?
C43 C44 C45 C48 -179.7(3) . . . . ?
C44 C45 C46 C47 1.5(4) . . . . ?
C48 C45 C46 C47 -178.4(3) . . . . ?
C43 N32 C47 C46 -0.5(4) . . . . ?
Ir31 N32 C47 C46 -179.13(19) . . . . ?
C45 C46 C47 N32 -1.5(4) . . . . ?
O32 Si32 C49 C51 32.0(2) . . . . ?
C52 Si32 C49 C51 -76.9(2) . . . . ?
Ir31 Si32 C49 C51 149.04(15) . . . . ?
O32 Si32 C49 C50 155.35(18) . . . . ?
C52 Si32 C49 C50 46.4(2) . . . . ?
Ir31 Si32 C49 C50 -87.7(2) . . . . ?
