#------------------------------------------------------------------------------
#$Date: 2025-01-06 14:31:52 +0200 (Mon, 06 Jan 2025) $
#$Revision: 297119 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/71/74/7717487.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_7717487
loop_
_publ_author_name
'Ziółkowska, Aleksandra'
'Kruczyński, Tomasz'
'Gudat, Dietrich'
'Ponikiewski, Łukasz'
_publ_section_title
;
 Phosphanylphosphaalkenes as precursors for metallaphosphaalkene
 complexes.
;
_journal_issue                   48
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              19107
_journal_page_last               19111
_journal_paper_doi               10.1039/d4dt03012e
_journal_volume                  53
_journal_year                    2024
_chemical_formula_moiety         'C30 H74 Li2 N4 O2 P4 Si2'
_chemical_formula_sum            'C30 H74 Li2 N4 O2 P4 Si2'
_chemical_formula_weight         716.87
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_audit_conform_dict_location     ftp://ftp.iucr.org/pub/cif_core.dic
_audit_conform_dict_name         cif_core.dic
_audit_conform_dict_version      2.4.3
_audit_creation_date             2024-05-16T11:30:48-00:00
_audit_creation_method           'WinGX routine CIF_UPDATE'
_audit_update_record
;
2024-09-23 deposited with the CCDC.	2024-11-13 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 104.656(4)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   19.6660(9)
_cell_length_b                   9.8948(3)
_cell_length_c                   23.2825(11)
_cell_measurement_reflns_used    9384
_cell_measurement_temperature    120(2)
_cell_measurement_theta_max      29.54
_cell_measurement_theta_min      2.32
_cell_measurement_wavelength     0.71073
_cell_volume                     4383.2(3)
_computing_cell_refinement
;
X-Area Recipe 1.33.0.0 (STOE, 2015)
;
_computing_data_collection
;
X-Area WinXpose 2.0.22.0 (STOE, 2016)
;
_computing_data_reduction
;
X-Area Integrate 1.72.0.0 (STOE, 2018)
X-Area X-Red32 1.63.4.0 (STOE, 2017) 
;
_computing_molecular_graphics    'Ortep for Windows (Farrugia, 2012)'
_computing_publication_material  'WinGX publication routines (Farrugia, 2012)'
_computing_structure_refinement  'SHELXL-2018/1 (Sheldrick, 2018)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      120(2)
_diffrn_detector                 'image plate (34 cm diameter)'
_diffrn_detector_area_resol_mean 6.67
_diffrn_detector_type            'STOE Imaging Plate'
_diffrn_measured_fraction_theta_full 0.987
_diffrn_measured_fraction_theta_max 0.99
_diffrn_measurement_details      ' 175 frames, detector distance = 100 mm'
_diffrn_measurement_device       '2-circle diffractometer'
_diffrn_measurement_device_type  'STOE IPDS 2T'
_diffrn_measurement_method       'rotation method, ω scans'
_diffrn_radiation_collimation    '0.6 mm diameter'
_diffrn_radiation_monochromator  'parabolic x-ray mirror'
_diffrn_radiation_polarisn_norm  270
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0406
_diffrn_reflns_av_unetI/netI     0.0653
_diffrn_reflns_Laue_measured_fraction_full 0.987
_diffrn_reflns_Laue_measured_fraction_max 0.99
_diffrn_reflns_limit_h_max       25
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            12015
_diffrn_reflns_point_group_measured_fraction_full 0.987
_diffrn_reflns_point_group_measured_fraction_max 0.99
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.994
_diffrn_reflns_theta_min         2.32
_diffrn_source                   'GeniX Mo, 0.05 x 0.05 mm2 microfocus'
_diffrn_source_current           1.000
_diffrn_source_power             0.050
_diffrn_source_voltage           50
_exptl_absorpt_coefficient_mu    0.255
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.086
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1568
_exptl_crystal_size_max          0.17
_exptl_crystal_size_mid          0.17
_exptl_crystal_size_min          0.16
_refine_diff_density_max         0.261
_refine_diff_density_min         -0.232
_refine_diff_density_rms         0.055
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.027
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_constraints    0
_refine_ls_number_parameters     206
_refine_ls_number_reflns         5238
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.027
_refine_ls_R_factor_all          0.0907
_refine_ls_R_factor_gt           0.0444
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0548P)²+0.0593P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0976
_refine_ls_wR_factor_ref         0.1113
_reflns_Friedel_coverage         0
_reflns_number_gt                3321
_reflns_number_total             5238
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d4dt03012e2.cif
_cod_data_source_block           shelx_CCDC3
_cod_depositor_comments
'Adding full bibliography for 7717484--7717490.cif.'
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               7717487
_shelx_estimated_absorpt_t_min   0.958
_shelx_estimated_absorpt_t_max   0.96
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -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_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
C1 C 0.35049(13) 1.0164(2) 0.36353(10) 0.0393(5) Uani 1 1 d . . . . .
H1A H 0.40237 1.022971 0.372884 0.047 Uiso 1 1 calc R U . . .
H1B H 0.336367 1.026839 0.401196 0.047 Uiso 1 1 calc R U . . .
C2 C 0.31951(18) 1.1306(3) 0.32283(13) 0.0662(9) Uani 1 1 d . . . . .
H2A H 0.335265 1.124166 0.286218 0.099 Uiso 1 1 calc R U . . .
H2B H 0.334921 1.216904 0.342457 0.099 Uiso 1 1 calc R U . . .
H2C H 0.268104 1.125158 0.313245 0.099 Uiso 1 1 calc R U . . .
C3 C 0.35119(11) 0.8466(3) 0.28545(9) 0.0371(5) Uani 1 1 d . . . . .
H3A H 0.335515 0.91884 0.255594 0.045 Uiso 1 1 calc R U . . .
H3B H 0.326874 0.762287 0.268939 0.045 Uiso 1 1 calc R U . . .
C4 C 0.42967(13) 0.8266(3) 0.29467(11) 0.0563(8) Uani 1 1 d . . . . .
H4A H 0.454314 0.910439 0.309721 0.084 Uiso 1 1 calc R U . . .
H4B H 0.439681 0.802537 0.256807 0.084 Uiso 1 1 calc R U . . .
H4C H 0.44572 0.753774 0.323448 0.084 Uiso 1 1 calc R U . . .
C5 C 0.38786(11) 0.7566(2) 0.47588(9) 0.0332(5) Uani 1 1 d . . . . .
H5A H 0.395772 0.701741 0.512541 0.04 Uiso 1 1 calc R U . . .
H5B H 0.361748 0.838522 0.482114 0.04 Uiso 1 1 calc R U . . .
C6 C 0.45912(11) 0.8007(2) 0.46832(10) 0.0405(6) Uani 1 1 d . . . . .
H6A H 0.487924 0.720839 0.466456 0.061 Uiso 1 1 calc R U . . .
H6B H 0.482686 0.857111 0.502109 0.061 Uiso 1 1 calc R U . . .
H6C H 0.452676 0.852763 0.43151 0.061 Uiso 1 1 calc R U . . .
C7 C 0.37912(11) 0.5645(2) 0.40632(10) 0.0350(5) Uani 1 1 d . . . . .
H7A H 0.42143 0.599385 0.395538 0.042 Uiso 1 1 calc R U . . .
H7B H 0.347746 0.524708 0.370212 0.042 Uiso 1 1 calc R U . . .
C8 C 0.40087(12) 0.4553(2) 0.45299(11) 0.0413(6) Uani 1 1 d . . . . .
H8A H 0.435054 0.492315 0.487575 0.062 Uiso 1 1 calc R U . . .
H8B H 0.422197 0.379937 0.436524 0.062 Uiso 1 1 calc R U . . .
H8C H 0.359442 0.423063 0.46505 0.062 Uiso 1 1 calc R U . . .
C9 C 0.13275(13) 0.9173(3) 0.27409(9) 0.0465(6) Uani 1 1 d . . . . .
H9A H 0.090563 0.895839 0.242712 0.07 Uiso 1 1 calc R U . . .
H9B H 0.173901 0.876138 0.264587 0.07 Uiso 1 1 calc R U . . .
H9C H 0.138915 1.01556 0.277016 0.07 Uiso 1 1 calc R U . . .
C10 C 0.05168(12) 0.9499(3) 0.36735(10) 0.0437(6) Uani 1 1 d . . . . .
H10A H 0.065852 1.044961 0.372439 0.066 Uiso 1 1 calc R U . . .
H10B H 0.043843 0.915124 0.404564 0.066 Uiso 1 1 calc R U . . .
H10C H 0.008176 0.942125 0.335758 0.066 Uiso 1 1 calc R U . . .
C11 C 0.08921(14) 0.6715(3) 0.33303(12) 0.0531(7) Uani 1 1 d . . . . .
H11A H 0.044695 0.671805 0.302333 0.08 Uiso 1 1 calc R U . . .
H11B H 0.081634 0.633662 0.369814 0.08 Uiso 1 1 calc R U . . .
H11C H 0.123686 0.616246 0.319735 0.08 Uiso 1 1 calc R U . . .
C12 C 0.21508(13) 0.3875(2) 0.38680(9) 0.0405(6) Uani 1 1 d . . . . .
H12A H 0.258431 0.332705 0.392844 0.049 Uiso 1 1 calc R U . . .
H12B H 0.213598 0.452314 0.354102 0.049 Uiso 1 1 calc R U . . .
C14 C 0.15114(14) 0.2982(3) 0.37260(11) 0.0465(6) Uani 1 1 d . . . . .
H14A H 0.158546 0.2171 0.350022 0.056 Uiso 1 1 calc R U . . .
H14B H 0.109129 0.347533 0.349845 0.056 Uiso 1 1 calc R U . . .
C15 C 0.14458(14) 0.2612(3) 0.43424(11) 0.0449(6) Uani 1 1 d . . . . .
H15A H 0.095901 0.234274 0.433553 0.054 Uiso 1 1 calc R U . . .
H15B H 0.17706 0.186935 0.45152 0.054 Uiso 1 1 calc R U . . .
C16 C 0.16458(13) 0.3901(2) 0.46790(10) 0.0411(6) Uani 1 1 d . . . . .
H16A H 0.122502 0.446862 0.465544 0.049 Uiso 1 1 calc R U . . .
H16B H 0.186987 0.370899 0.510191 0.049 Uiso 1 1 calc R U . . .
Li1 Li 0.25842(18) 0.6269(4) 0.46640(15) 0.0308(8) Uani 1 1 d . . . . .
N1 N 0.32941(9) 0.88253(18) 0.33932(7) 0.0314(4) Uani 1 1 d . . . . .
N2 N 0.34246(8) 0.67804(18) 0.42693(7) 0.0272(4) Uani 1 1 d . . . . .
O1 O 0.21330(8) 0.45821(15) 0.44061(6) 0.0340(4) Uani 1 1 d . . . . .
P2 P 0.28454(3) 0.76326(6) 0.36727(2) 0.02661(14) Uani 1 1 d . . . . .
P1 P 0.22175(3) 0.86973(6) 0.41766(2) 0.02688(14) Uani 1 1 d . . . . .
Si1 Si 0.12292(3) 0.84904(6) 0.34680(3) 0.03250(16) Uani 1 1 d . . . . .
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 0 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Li Li -0.0003 0.0001 '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 0.006 '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
N1 C1 C2 114.2(2) . . ?
N1 C1 H1A 108.7 . . ?
C2 C1 H1A 108.7 . . ?
N1 C1 H1B 108.7 . . ?
C2 C1 H1B 108.7 . . ?
H1A C1 H1B 107.6 . . ?
C1 C2 H2A 109.5 . . ?
C1 C2 H2B 109.5 . . ?
H2A C2 H2B 109.5 . . ?
C1 C2 H2C 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
N1 C3 C4 114.66(19) . . ?
N1 C3 H3A 108.6 . . ?
C4 C3 H3A 108.6 . . ?
N1 C3 H3B 108.6 . . ?
C4 C3 H3B 108.6 . . ?
H3A C3 H3B 107.6 . . ?
C3 C4 H4A 109.5 . . ?
C3 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
C3 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
N2 C5 C6 117.17(18) . . ?
N2 C5 H5A 108 . . ?
C6 C5 H5A 108 . . ?
N2 C5 H5B 108 . . ?
C6 C5 H5B 108 . . ?
H5A C5 H5B 107.2 . . ?
C5 C6 H6A 109.5 . . ?
C5 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
C5 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
N2 C7 C8 112.42(17) . . ?
N2 C7 H7A 109.1 . . ?
C8 C7 H7A 109.1 . . ?
N2 C7 H7B 109.1 . . ?
C8 C7 H7B 109.1 . . ?
H7A C7 H7B 107.9 . . ?
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 . . ?
Si1 C9 H9A 109.5 . . ?
Si1 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
Si1 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
Si1 C10 H10A 109.5 . . ?
Si1 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
Si1 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
Si1 C11 H11A 109.5 . . ?
Si1 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
Si1 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
O1 C12 C14 105.85(17) . . ?
O1 C12 H12A 110.6 . . ?
C14 C12 H12A 110.6 . . ?
O1 C12 H12B 110.6 . . ?
C14 C12 H12B 110.6 . . ?
H12A C12 H12B 108.7 . . ?
C12 C14 C15 101.55(19) . . ?
C12 C14 H14A 111.5 . . ?
C15 C14 H14A 111.5 . . ?
C12 C14 H14B 111.5 . . ?
C15 C14 H14B 111.5 . . ?
H14A C14 H14B 109.3 . . ?
C16 C15 C14 102.47(19) . . ?
C16 C15 H15A 111.3 . . ?
C14 C15 H15A 111.3 . . ?
C16 C15 H15B 111.3 . . ?
C14 C15 H15B 111.3 . . ?
H15A C15 H15B 109.2 . . ?
O1 C16 C15 106.44(17) . . ?
O1 C16 H16A 110.4 . . ?
C15 C16 H16A 110.4 . . ?
O1 C16 H16B 110.4 . . ?
C15 C16 H16B 110.4 . . ?
H16A C16 H16B 108.6 . . ?
O1 Li1 N2 114.68(17) . . ?
O1 Li1 P1 105.66(15) . 7_566 ?
N2 Li1 P1 120.45(16) . 7_566 ?
O1 Li1 P1 126.58(17) . . ?
N2 Li1 P1 76.15(11) . . ?
P1 Li1 P1 112.21(13) 7_566 . ?
O1 Li1 P2 108.98(14) . . ?
N2 Li1 P2 38.71(7) . . ?
P1 Li1 P2 145.19(15) 7_566 . ?
P1 Li1 P2 46.49(6) . . ?
O1 Li1 Li1 141.2(2) . 7_566 ?
N2 Li1 Li1 103.51(19) . 7_566 ?
P1 Li1 Li1 56.90(11) 7_566 7_566 ?
P1 Li1 Li1 55.31(11) . 7_566 ?
P2 Li1 Li1 96.10(16) . 7_566 ?
C1 N1 C3 115.73(18) . . ?
C1 N1 P2 127.41(14) . . ?
C3 N1 P2 116.84(15) . . ?
C5 N2 C7 113.61(16) . . ?
C5 N2 P2 119.83(14) . . ?
C7 N2 P2 112.13(13) . . ?
C5 N2 Li1 100.04(15) . . ?
C7 N2 Li1 116.84(16) . . ?
P2 N2 Li1 92.06(12) . . ?
C12 O1 C16 108.69(16) . . ?
C12 O1 Li1 125.73(16) . . ?
C16 O1 Li1 125.13(16) . . ?
N1 P2 N2 109.75(9) . . ?
N1 P2 P1 106.89(7) . . ?
N2 P2 P1 98.49(6) . . ?
N1 P2 Li1 149.62(10) . . ?
N2 P2 Li1 49.23(9) . . ?
P1 P2 Li1 63.05(7) . . ?
P2 P1 Si1 93.68(3) . . ?
P2 P1 Li1 127.04(8) . 7_566 ?
Si1 P1 Li1 129.76(8) . 7_566 ?
P2 P1 Li1 70.46(7) . . ?
Si1 P1 Li1 108.89(8) . . ?
Li1 P1 Li1 67.79(13) 7_566 . ?
C11 Si1 C9 107.17(13) . . ?
C11 Si1 C10 106.67(12) . . ?
C9 Si1 C10 106.99(11) . . ?
C11 Si1 P1 114.76(8) . . ?
C9 Si1 P1 111.52(8) . . ?
C10 Si1 P1 109.35(8) . . ?
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
C1 N1 1.458(3) . ?
C1 C2 1.501(3) . ?
C1 H1A 0.99 . ?
C1 H1B 0.99 . ?
C2 H2A 0.98 . ?
C2 H2B 0.98 . ?
C2 H2C 0.98 . ?
C3 N1 1.468(2) . ?
C3 C4 1.516(3) . ?
C3 H3A 0.99 . ?
C3 H3B 0.99 . ?
C4 H4A 0.98 . ?
C4 H4B 0.98 . ?
C4 H4C 0.98 . ?
C5 N2 1.478(3) . ?
C5 C6 1.520(3) . ?
C5 H5A 0.99 . ?
C5 H5B 0.99 . ?
C6 H6A 0.98 . ?
C6 H6B 0.98 . ?
C6 H6C 0.98 . ?
C7 N2 1.479(3) . ?
C7 C8 1.515(3) . ?
C7 H7A 0.99 . ?
C7 H7B 0.99 . ?
C8 H8A 0.98 . ?
C8 H8B 0.98 . ?
C8 H8C 0.98 . ?
C9 Si1 1.878(2) . ?
C9 H9A 0.98 . ?
C9 H9B 0.98 . ?
C9 H9C 0.98 . ?
C10 Si1 1.878(2) . ?
C10 H10A 0.98 . ?
C10 H10B 0.98 . ?
C10 H10C 0.98 . ?
C11 Si1 1.877(3) . ?
C11 H11A 0.98 . ?
C11 H11B 0.98 . ?
C11 H11C 0.98 . ?
C12 O1 1.443(2) . ?
C12 C14 1.504(3) . ?
C12 H12A 0.99 . ?
C12 H12B 0.99 . ?
C14 C15 1.518(3) . ?
C14 H14A 0.99 . ?
C14 H14B 0.99 . ?
C15 C16 1.496(3) . ?
C15 H15A 0.99 . ?
C15 H15B 0.99 . ?
C16 O1 1.444(2) . ?
C16 H16A 0.99 . ?
C16 H16B 0.99 . ?
Li1 O1 1.914(4) . ?
Li1 N2 2.145(4) . ?
Li1 P1 2.628(3) 7_566 ?
Li1 P1 2.677(4) . ?
Li1 P2 2.830(3) . ?
Li1 Li1 2.959(7) 7_566 ?
N1 P2 1.6987(18) . ?
N2 P2 1.7712(17) . ?
P2 P1 2.1781(7) . ?
P1 Si1 2.2178(8) . ?
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
O1 C12 C14 C15 -33.6(3) . . . . ?
C12 C14 C15 C16 38.0(3) . . . . ?
C14 C15 C16 O1 -29.6(3) . . . . ?
C2 C1 N1 C3 62.8(3) . . . . ?
C2 C1 N1 P2 -118.8(2) . . . . ?
C4 C3 N1 C1 68.8(3) . . . . ?
C4 C3 N1 P2 -109.8(2) . . . . ?
C6 C5 N2 C7 48.4(2) . . . . ?
C6 C5 N2 P2 -88.1(2) . . . . ?
C6 C5 N2 Li1 173.68(19) . . . . ?
C8 C7 N2 C5 66.6(2) . . . . ?
C8 C7 N2 P2 -153.60(16) . . . . ?
C8 C7 N2 Li1 -49.2(2) . . . . ?
C14 C12 O1 C16 15.9(3) . . . . ?
C14 C12 O1 Li1 -156.7(2) . . . . ?
C15 C16 O1 C12 8.9(3) . . . . ?
C15 C16 O1 Li1 -178.4(2) . . . . ?
C1 N1 P2 N2 -79.25(19) . . . . ?
C3 N1 P2 N2 99.15(16) . . . . ?
C1 N1 P2 P1 26.59(19) . . . . ?
C3 N1 P2 P1 -155.02(13) . . . . ?
C1 N1 P2 Li1 -38.7(3) . . . . ?
C3 N1 P2 Li1 139.73(19) . . . . ?
C5 N2 P2 N1 51.44(16) . . . . ?
C7 N2 P2 N1 -85.59(15) . . . . ?
Li1 N2 P2 N1 154.25(12) . . . . ?
C5 N2 P2 P1 -60.01(14) . . . . ?
C7 N2 P2 P1 162.96(13) . . . . ?
Li1 N2 P2 P1 42.80(11) . . . . ?
C5 N2 P2 Li1 -102.81(17) . . . . ?
C7 N2 P2 Li1 120.15(18) . . . . ?
