# Supplementary Information (SI) for New Journal of Chemistry.
# This journal is © The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 2025

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_exp_14288_auto
_database_code_depnum_ccdc_archive 'CCDC 2426747'
loop_
_audit_author_name
_audit_author_address
'Yu Zeng'
;south china normal university
China
;
_audit_update_record             
;
2025-02-25 deposited with the CCDC.	2025-09-29 downloaded from the CCDC.
;
_audit_creation_date             2024-04-26
_audit_creation_method           
;
Olex2 1.5
(compiled 2024.02.16 svn.r378c4104 for OlexSys, GUI svn.r6928)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C25 H18 N2 O'
_chemical_formula_sum            'C25 H18 N2 O'
_chemical_formula_weight         362.41
_chemical_absolute_configuration .
_chemical_melting_point          ?
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'
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'

_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.
;
_space_group_crystal_system      orthorhombic
_space_group_IT_number           29
_space_group_name_H-M_alt        'P c a 21'
_space_group_name_Hall           'P 2c -2ac'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z+1/2'
'x+1/2, -y, z'
'-x+1/2, y, z+1/2'

_cell_length_a                   18.8420(12)
_cell_length_b                   6.2924(3)
_cell_length_c                   16.2912(11)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     1931.5(2)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    3122
_cell_measurement_temperature    297
_cell_measurement_theta_max      23.2760
_cell_measurement_theta_min      2.5010
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    0.077
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.53908
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.42.99a (Rigaku Oxford Diffraction, 2023)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.246
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             760
_exptl_crystal_size_max          ?
_exptl_crystal_size_mid          ?
_exptl_crystal_size_min          ?
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0437
_diffrn_reflns_av_unetI/netI     0.0525
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.916
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -25
_diffrn_reflns_limit_k_max       8
_diffrn_reflns_limit_k_min       -8
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            16130
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.875
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         29.323
_diffrn_reflns_theta_min         2.162
_diffrn_ambient_temperature      297
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 8.0606
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.916
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -39.00  44.70   0.90    2.50    --   17.12 -77.00 150.00   93
  2  ω     -1.00  74.60   0.90    2.50    --   17.12  57.00  30.00   84
  3  ω      5.00  85.10   0.90    2.50    --   17.12  57.00 -60.00   89
  4  ω    -25.00   8.30   0.90    2.50    --  -17.59 -77.00-180.00   37
  5  ω    -14.00  14.80   0.90    2.50    --  -17.59  77.00  90.00   32
  6  ω    -17.00  51.40   0.90    2.50    --  -17.59  37.00-120.00   76
  7  ω    -39.00   6.90   0.90    2.50    --  -17.59 -77.00  30.00   51
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.0349247000
_diffrn_orient_matrix_UB_12      -0.0177594000
_diffrn_orient_matrix_UB_13      -0.0147533000
_diffrn_orient_matrix_UB_21      -0.0116061000
_diffrn_orient_matrix_UB_22      0.0212451000
_diffrn_orient_matrix_UB_23      -0.0405995000
_diffrn_orient_matrix_UB_31      0.0079067000
_diffrn_orient_matrix_UB_32      0.1092602000
_diffrn_orient_matrix_UB_33      0.0054906000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Mo) X-ray Source'
_reflns_Friedel_coverage         0.847
_reflns_Friedel_fraction_full    0.996
_reflns_Friedel_fraction_max     0.831
_reflns_number_gt                3283
_reflns_number_total             4639
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrysAlisPro 1.171.42.99a (Rigaku OD, 2023)'
_computing_data_collection       'CrysAlisPro 1.171.42.99a (Rigaku OD, 2023)'
_computing_data_reduction        'CrysAlisPro 1.171.42.99a (Rigaku OD, 2023)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_refine_diff_density_max         0.129
_refine_diff_density_min         -0.185
_refine_diff_density_rms         0.038
_refine_ls_abs_structure_details 
;
 Flack x determined using 1063 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   0.8(9)
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.068
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     254
_refine_ls_number_reflns         4639
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0923
_refine_ls_R_factor_gt           0.0596
_refine_ls_restrained_S_all      1.068
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0487P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1065
_refine_ls_wR_factor_ref         0.1199
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Aromatic/amide H refined with riding coordinates:
 C2(H2), C5(H5), C7(H7), C9(H9), C11(H11), C14(H14), C15(H15), C17(H17),
 C19(H19), C20(H20), C21(H21), C22(H22), C23(H23), C24(H24), C25(H25)
2.b Idealised Me refined as rotating group:
 C3(H3A,H3B,H3C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
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
O1 O 0.77871(11) 0.2075(3) 0.52881(13) 0.0441(6) Uani 1 1 d . . . . .
N1 N 0.75346(14) 0.4793(4) 0.43100(16) 0.0440(6) Uani 1 1 d . . . . .
N2 N 0.57681(19) 0.2505(5) 0.3600(2) 0.0729(10) Uani 1 1 d . . . . .
C1 C 0.83272(16) 0.7684(4) 0.4056(2) 0.0422(7) Uani 1 1 d . . . . .
C2 C 0.89952(19) 0.8557(6) 0.4199(3) 0.0604(10) Uani 1 1 d . . . . .
H2 H 0.930024 0.791746 0.457377 0.072 Uiso 1 1 calc R U . . .
C3 C 0.9014(3) 1.3335(6) 0.2781(3) 0.0839(15) Uani 1 1 d . . . . .
H3A H 0.925686 1.290932 0.228932 0.126 Uiso 1 1 calc R U . . .
H3B H 0.932964 1.414872 0.311983 0.126 Uiso 1 1 calc R U . . .
H3C H 0.860925 1.418553 0.263859 0.126 Uiso 1 1 calc R U . . .
C4 C 0.74408(18) 0.0313(4) 0.5605(2) 0.0429(7) Uani 1 1 d . . . . .
C5 C 0.9207(2) 1.0372(6) 0.3786(3) 0.0679(11) Uani 1 1 d . . . . .
H5 H 0.965840 1.091548 0.388160 0.082 Uiso 1 1 calc R U . . .
C6 C 0.61954(19) 0.2220(5) 0.4083(2) 0.0493(8) Uani 1 1 d . . . . .
C7 C 0.58925(19) -0.2610(6) 0.4875(2) 0.0558(9) Uani 1 1 d . . . . .
H7 H 0.607608 -0.263322 0.434551 0.067 Uiso 1 1 calc R U . . .
C8 C 0.61945(17) -0.1316(5) 0.5454(2) 0.0426(8) Uani 1 1 d . . . . .
C9 C 0.8490(2) -0.0189(5) 0.6492(3) 0.0603(10) Uani 1 1 d . . . . .
H9 H 0.864495 0.116080 0.634478 0.072 Uiso 1 1 calc R U . . .
C10 C 0.67836(17) 0.0144(5) 0.52542(19) 0.0413(7) Uani 1 1 d . . . . .
C11 C 0.8897(2) -0.1401(7) 0.7022(3) 0.0716(12) Uani 1 1 d . . . . .
H11 H 0.931984 -0.085857 0.722908 0.086 Uiso 1 1 calc R U . . .
C12 C 0.73572(17) 0.2986(5) 0.4719(2) 0.0434(8) Uani 1 1 d . . . . .
C13 C 0.8772(2) 1.1387(5) 0.3243(2) 0.0552(10) Uani 1 1 d . . . . .
C14 C 0.78861(18) 0.8716(5) 0.35089(19) 0.0459(8) Uani 1 1 d . . . . .
H14 H 0.743628 0.817143 0.340388 0.055 Uiso 1 1 calc R U . . .
C15 C 0.59191(19) -0.1356(6) 0.6246(2) 0.0570(9) Uani 1 1 d . . . . .
H15 H 0.612037 -0.050552 0.665054 0.068 Uiso 1 1 calc R U . . .
C16 C 0.78570(17) -0.0948(5) 0.61778(19) 0.0432(8) Uani 1 1 d . . . . .
C17 C 0.8679(2) -0.3396(7) 0.7243(3) 0.0665(11) Uani 1 1 d . . . . .
H17 H 0.895261 -0.421025 0.759891 0.080 Uiso 1 1 calc R U . . .
C18 C 0.67442(17) 0.1832(5) 0.46658(19) 0.0428(8) Uani 1 1 d . . . . .
C19 C 0.5052(2) -0.3908(6) 0.5848(3) 0.0714(12) Uani 1 1 d . . . . .
H19 H 0.466882 -0.478035 0.597611 0.086 Uiso 1 1 calc R U . . .
C20 C 0.7644(2) -0.2984(5) 0.6402(2) 0.0529(9) Uani 1 1 d . . . . .
H20 H 0.722356 -0.354249 0.619486 0.064 Uiso 1 1 calc R U . . .
C21 C 0.5318(2) -0.3883(6) 0.5069(3) 0.0716(12) Uani 1 1 d . . . . .
H21 H 0.511247 -0.472710 0.466526 0.086 Uiso 1 1 calc R U . . .
C22 C 0.81245(18) 0.5737(5) 0.4465(2) 0.0463(8) Uani 1 1 d . . . . .
H22 H 0.843018 0.515083 0.485124 0.056 Uiso 1 1 calc R U . . .
C23 C 0.5349(2) -0.2650(7) 0.6438(3) 0.0679(11) Uani 1 1 d . . . . .
H23 H 0.516750 -0.266226 0.696937 0.081 Uiso 1 1 calc R U . . .
C24 C 0.8104(2) 1.0544(5) 0.3117(2) 0.0539(9) Uani 1 1 d . . . . .
H24 H 0.779413 1.122641 0.275900 0.065 Uiso 1 1 calc R U . . .
C25 C 0.8056(2) -0.4185(6) 0.6935(3) 0.0628(11) Uani 1 1 d . . . . .
H25 H 0.790779 -0.554051 0.708450 0.075 Uiso 1 1 calc R U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
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
O1 C4 1.386(3) . ?
O1 C12 1.358(4) . ?
N1 C12 1.360(4) . ?
N1 C22 1.285(4) . ?
N2 C6 1.140(5) . ?
C1 C2 1.393(4) . ?
C1 C14 1.381(4) . ?
C1 C22 1.445(4) . ?
C2 H2 0.9300 . ?
C2 C5 1.384(5) . ?
C3 H3A 0.9600 . ?
C3 H3B 0.9600 . ?
C3 H3C 0.9600 . ?
C3 C13 1.509(5) . ?
C4 C10 1.368(4) . ?
C4 C16 1.454(4) . ?
C5 H5 0.9300 . ?
C5 C13 1.365(5) . ?
C6 C18 1.425(5) . ?
C7 H7 0.9300 . ?
C7 C8 1.370(5) . ?
C7 C21 1.382(5) . ?
C8 C10 1.477(4) . ?
C8 C15 1.391(5) . ?
C9 H9 0.9300 . ?
C9 C11 1.384(5) . ?
C9 C16 1.383(5) . ?
C10 C18 1.433(4) . ?
C11 H11 0.9300 . ?
C11 C17 1.368(6) . ?
C12 C18 1.367(4) . ?
C13 C24 1.381(5) . ?
C14 H14 0.9300 . ?
C14 C24 1.379(5) . ?
C15 H15 0.9300 . ?
C15 C23 1.384(5) . ?
C16 C20 1.392(4) . ?
C17 H17 0.9300 . ?
C17 C25 1.370(6) . ?
C19 H19 0.9300 . ?
C19 C21 1.365(6) . ?
C19 C23 1.366(6) . ?
C20 H20 0.9300 . ?
C20 C25 1.388(5) . ?
C21 H21 0.9300 . ?
C22 H22 0.9300 . ?
C23 H23 0.9300 . ?
C24 H24 0.9300 . ?
C25 H25 0.9300 . ?

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
C12 O1 C4 108.1(2) . . ?
C22 N1 C12 120.2(3) . . ?
C2 C1 C22 119.7(3) . . ?
C14 C1 C2 117.8(3) . . ?
C14 C1 C22 122.5(3) . . ?
C1 C2 H2 119.9 . . ?
C5 C2 C1 120.3(4) . . ?
C5 C2 H2 119.9 . . ?
H3A C3 H3B 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C13 C3 H3A 109.5 . . ?
C13 C3 H3B 109.5 . . ?
C13 C3 H3C 109.5 . . ?
O1 C4 C16 114.9(3) . . ?
C10 C4 O1 109.4(3) . . ?
C10 C4 C16 135.5(3) . . ?
C2 C5 H5 119.1 . . ?
C13 C5 C2 121.9(3) . . ?
C13 C5 H5 119.1 . . ?
N2 C6 C18 178.1(4) . . ?
C8 C7 H7 119.6 . . ?
C8 C7 C21 120.8(3) . . ?
C21 C7 H7 119.6 . . ?
C7 C8 C10 122.0(3) . . ?
C7 C8 C15 118.2(3) . . ?
C15 C8 C10 119.7(3) . . ?
C11 C9 H9 119.4 . . ?
C16 C9 H9 119.4 . . ?
C16 C9 C11 121.3(3) . . ?
C4 C10 C8 129.5(3) . . ?
C4 C10 C18 105.6(3) . . ?
C18 C10 C8 124.7(3) . . ?
C9 C11 H11 119.9 . . ?
C17 C11 C9 120.2(4) . . ?
C17 C11 H11 119.9 . . ?
O1 C12 N1 122.7(3) . . ?
O1 C12 C18 108.9(3) . . ?
N1 C12 C18 128.4(3) . . ?
C5 C13 C3 121.5(4) . . ?
C5 C13 C24 117.6(3) . . ?
C24 C13 C3 120.9(4) . . ?
C1 C14 H14 119.6 . . ?
C24 C14 C1 120.8(3) . . ?
C24 C14 H14 119.6 . . ?
C8 C15 H15 119.7 . . ?
C23 C15 C8 120.7(4) . . ?
C23 C15 H15 119.7 . . ?
C9 C16 C4 121.0(3) . . ?
C9 C16 C20 118.0(3) . . ?
C20 C16 C4 121.0(3) . . ?
C11 C17 H17 120.2 . . ?
C11 C17 C25 119.6(4) . . ?
C25 C17 H17 120.2 . . ?
C6 C18 C10 127.6(3) . . ?
C12 C18 C6 124.4(3) . . ?
C12 C18 C10 107.9(3) . . ?
C21 C19 H19 120.1 . . ?
C21 C19 C23 119.8(4) . . ?
C23 C19 H19 120.1 . . ?
C16 C20 H20 119.9 . . ?
C25 C20 C16 120.3(4) . . ?
C25 C20 H20 119.9 . . ?
C7 C21 H21 119.8 . . ?
C19 C21 C7 120.5(4) . . ?
C19 C21 H21 119.8 . . ?
N1 C22 C1 122.0(3) . . ?
N1 C22 H22 119.0 . . ?
C1 C22 H22 119.0 . . ?
C15 C23 H23 120.0 . . ?
C19 C23 C15 120.0(4) . . ?
C19 C23 H23 120.0 . . ?
C13 C24 H24 119.2 . . ?
C14 C24 C13 121.5(3) . . ?
C14 C24 H24 119.2 . . ?
C17 C25 C20 120.7(4) . . ?
C17 C25 H25 119.6 . . ?
C20 C25 H25 119.6 . . ?

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 C4 C10 C8 -172.7(3) . . . . ?
O1 C4 C10 C18 2.8(3) . . . . ?
O1 C4 C16 C9 12.0(4) . . . . ?
O1 C4 C16 C20 -165.6(3) . . . . ?
O1 C12 C18 C6 -174.6(3) . . . . ?
O1 C12 C18 C10 2.0(3) . . . . ?
N1 C12 C18 C6 7.4(5) . . . . ?
N1 C12 C18 C10 -176.1(3) . . . . ?
C1 C2 C5 C13 1.3(6) . . . . ?
C1 C14 C24 C13 1.2(5) . . . . ?
C2 C1 C14 C24 0.3(5) . . . . ?
C2 C1 C22 N1 -175.1(3) . . . . ?
C2 C5 C13 C3 -178.5(4) . . . . ?
C2 C5 C13 C24 0.2(6) . . . . ?
C3 C13 C24 C14 177.3(3) . . . . ?
C4 O1 C12 N1 178.0(3) . . . . ?
C4 O1 C12 C18 -0.2(3) . . . . ?
C4 C10 C18 C6 173.4(3) . . . . ?
C4 C10 C18 C12 -2.9(3) . . . . ?
C4 C16 C20 C25 178.5(3) . . . . ?
C5 C13 C24 C14 -1.5(5) . . . . ?
C7 C8 C10 C4 -124.7(4) . . . . ?
C7 C8 C10 C18 60.5(5) . . . . ?
C7 C8 C15 C23 -0.9(5) . . . . ?
C8 C7 C21 C19 -1.5(6) . . . . ?
C8 C10 C18 C6 -10.7(5) . . . . ?
C8 C10 C18 C12 172.9(3) . . . . ?
C8 C15 C23 C19 0.2(6) . . . . ?
C9 C11 C17 C25 0.0(6) . . . . ?
C9 C16 C20 C25 0.8(5) . . . . ?
C10 C4 C16 C9 -172.2(4) . . . . ?
C10 C4 C16 C20 10.2(5) . . . . ?
C10 C8 C15 C23 177.4(3) . . . . ?
C11 C9 C16 C4 -178.4(3) . . . . ?
C11 C9 C16 C20 -0.8(5) . . . . ?
C11 C17 C25 C20 0.0(6) . . . . ?
C12 O1 C4 C10 -1.7(3) . . . . ?
C12 O1 C4 C16 175.2(2) . . . . ?
C12 N1 C22 C1 -178.8(3) . . . . ?
C14 C1 C2 C5 -1.5(5) . . . . ?
C14 C1 C22 N1 3.7(5) . . . . ?
C15 C8 C10 C4 57.1(5) . . . . ?
C15 C8 C10 C18 -117.7(4) . . . . ?
C16 C4 C10 C8 11.3(6) . . . . ?
C16 C4 C10 C18 -173.1(3) . . . . ?
C16 C9 C11 C17 0.3(6) . . . . ?
C16 C20 C25 C17 -0.4(5) . . . . ?
C21 C7 C8 C10 -176.7(3) . . . . ?
C21 C7 C8 C15 1.6(5) . . . . ?
C21 C19 C23 C15 -0.1(6) . . . . ?
C22 N1 C12 O1 -1.3(5) . . . . ?
C22 N1 C12 C18 176.6(3) . . . . ?
C22 C1 C2 C5 177.4(3) . . . . ?
C22 C1 C14 C24 -178.5(3) . . . . ?
C23 C19 C21 C7 0.8(6) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.360
_oxdiff_exptl_absorpt_empirical_full_min 0.637
