data_bilm001
_audit_creation_date               2021-05-12
_audit_creation_method
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6272)
;
_shelx_SHELXL_version_number       '2018/3'
_audit_contact_author_address      ?
_audit_contact_author_email        ?
_audit_contact_author_name         ''
_audit_contact_author_phone        ?
_publ_contact_author_id_orcid      ?
_publ_section_references
;
Dolomanov, O.V., Bourhis, L.J., Gildea, R.J, Howard, J.A.K. & Puschmann, H.
 (2009), J. Appl. Cryst. 42, 339-341.

Sheldrick, G.M. (2008). Acta Cryst. A64, 112-122.

Sheldrick, G.M. (2015). Acta Cryst. A71, 3-8.
;
_chemical_name_common              ?
_chemical_name_systematic          ?
_chemical_formula_moiety           'C18 H19 N O'
_chemical_formula_sum              'C18 H19 N O'
_chemical_formula_weight           265.34
_chemical_absolute_configuration   ad
_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' 0.0181 0.0091 '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' 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'O' 'O' 0.0492 0.0322 '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             19
_space_group_name_H-M_alt          'P 21 21 21'
_space_group_name_Hall             'P 2ac 2ab'
loop_
  _space_group_symop_operation_xyz
 'x, y, z'
 '-x+1/2, -y, z+1/2'
 '-x, y+1/2, -z+1/2'
 'x+1/2, -y+1/2, -z'

_cell_length_a                     6.9787(4)
_cell_length_b                     12.4957(8)
_cell_length_c                     16.1330(11)
_cell_angle_alpha                  90
_cell_angle_beta                   90
_cell_angle_gamma                  90
_cell_volume                       1406.86(15)
_cell_formula_units_Z              4
_cell_measurement_reflns_used      6723
_cell_measurement_temperature      120
_cell_measurement_theta_max        75.27
_cell_measurement_theta_min        5.48
_shelx_estimated_absorpt_T_max     0.966
_shelx_estimated_absorpt_T_min     0.882
_exptl_absorpt_coefficient_mu      0.599
_exptl_absorpt_correction_T_max    0.7539
_exptl_absorpt_correction_T_min    0.7009
_exptl_absorpt_correction_type     multi-scan
_exptl_absorpt_process_details
;
SADABS-2016/2 (Bruker,2016) was used for absorption correction.
wR2(int) was 0.0787 before and 0.0394 after correction.
The Ratio of minimum to maximum transmission is 0.9297.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details     ?
_exptl_crystal_colour              'clear colourless'
_exptl_crystal_colour_lustre       clear
_exptl_crystal_colour_primary      colourless
_exptl_crystal_density_diffrn      1.253
_exptl_crystal_density_meas        ?
_exptl_crystal_density_method      ?
_exptl_crystal_description         needle
_exptl_crystal_F_000               568
loop_
  _exptl_crystal_face_index_h
  _exptl_crystal_face_index_k
  _exptl_crystal_face_index_l
  _exptl_crystal_face_perp_dist
 1.00 -1.00 1.00 0.0710
 -1.00 1.00 -1.00 0.0550
 0.00 0.00 1.00 0.0260
 1.00 3.00 -1.00 0.0770
 -1.00 -3.00 1.00 0.0640
 1.00 -2.00 1.00 0.0570
 -1.00 2.00 -1.00 0.0430
 0.00 -3.00 1.00 0.0300
 0.00 3.00 -1.00 0.0390
 0.00 -1.00 -3.00 0.0030
 0.00 1.00 2.00 0.0320

_exptl_crystal_recrystallization_method 
 'Slow evaporation of solution in acetonitrile/hexanes.'
_exptl_crystal_size_max            0.214
_exptl_crystal_size_mid            0.08
_exptl_crystal_size_min            0.059
_exptl_special_details
;
Data collection is performed with four batch runs at 
φ = 0.00 ° (600 frames), at φ = 90.00 ° 
(600 frames), at φ = 180 ° (600 frames) and 
at φ = 270 ° (600 frames). 
Frame width = 0.30 \& in ω. 
;
_exptl_transmission_factor_max     ?
_exptl_transmission_factor_min     ?
_diffrn_reflns_av_R_equivalents    0.0246
_diffrn_reflns_av_unetI/netI       0.0245
_diffrn_reflns_Laue_measured_fraction_full  0.999
_diffrn_reflns_Laue_measured_fraction_max  0.996
_diffrn_reflns_limit_h_max         8
_diffrn_reflns_limit_h_min         -7
_diffrn_reflns_limit_k_max         15
_diffrn_reflns_limit_k_min         -15
_diffrn_reflns_limit_l_max         20
_diffrn_reflns_limit_l_min         -19
_diffrn_reflns_number              10188
_diffrn_reflns_point_group_measured_fraction_full  0.999
_diffrn_reflns_point_group_measured_fraction_max  0.992
_diffrn_reflns_theta_full          67.679
_diffrn_reflns_theta_max           75.265
_diffrn_reflns_theta_min           4.476
_diffrn_ambient_temperature        120
_diffrn_detector_area_resol_mean   8.33
_diffrn_measured_fraction_theta_full  0.999
_diffrn_measured_fraction_theta_max  0.996
_diffrn_measurement_device_type    'Bruker APEX-II CCD'
_diffrn_measurement_method         'φ and ω scans'
_diffrn_radiation_monochromator    ?
_diffrn_radiation_probe            X-ray
_diffrn_radiation_type             'Cu K\a'
_diffrn_radiation_wavelength       1.54178
_diffrn_source                     'microfocus sealed tube'
_diffrn_source_current             0.65
_diffrn_source_power               0.029055
_diffrn_source_voltage             44.7
_diffrn_standards_number           0
_reflns_Friedel_coverage           0.714
_reflns_Friedel_fraction_full      0.999
_reflns_Friedel_fraction_max       0.988
_reflns_number_gt                  2770
_reflns_number_total               2889
_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         ?
_computing_data_collection         ?
_computing_data_reduction          ?
_computing_molecular_graphics      'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement    'XL  (Sheldrick, 2008)'
_computing_structure_solution      'SHELXT  (Sheldrick, 2015)'
_refine_diff_density_max           0.165
_refine_diff_density_min           -0.156
_refine_diff_density_rms           0.030
_refine_ls_abs_structure_details
;
 Flack x determined using 1133 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack     0.03(10)
_refine_ls_extinction_coef         .
_refine_ls_extinction_method       none
_refine_ls_goodness_of_fit_ref     1.067
_refine_ls_hydrogen_treatment      refall
_refine_ls_matrix_type             full
_refine_ls_number_parameters       257
_refine_ls_number_reflns           2889
_refine_ls_number_restraints       0
_refine_ls_R_factor_all            0.0301
_refine_ls_R_factor_gt             0.0288
_refine_ls_restrained_S_all        1.067
_refine_ls_shift/su_max            0.000
_refine_ls_shift/su_mean           0.000
_refine_ls_structure_factor_coef   Fsqd
_refine_ls_weighting_details      
 'w=1/[σ²(Fo²)+(0.0374P)²+0.2309P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme        calc
_refine_ls_wR_factor_gt            0.0728
_refine_ls_wR_factor_ref           0.0738
_refine_special_details            ?
_olex2_refinement_description
;
;
_atom_sites_solution_hydrogens     difmap
_atom_sites_solution_primary       dual
_atom_sites_solution_secondary     difmap
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 0.62182(18) 0.32365(9) 0.60906(8) 0.0279(3) Uani 1 1 d . . . . .
 N1 N 0.6467(2) 0.42608(11) 0.49363(8) 0.0225(3) Uani 1 1 d . . . . .
 C1 C 0.5903(2) 0.40883(12) 0.57403(10) 0.0210(3) Uani 1 1 d . . . . .
 C2 C 0.4967(2) 0.50285(12) 0.61794(10) 0.0193(3) Uani 1 1 d . . . . .
 C3 C 0.3631(2) 0.56133(12) 0.55752(9) 0.0206(3) Uani 1 1 d . . . . .
 H3 H 0.315(3) 0.6244(15) 0.5867(11) 0.019(5) Uiso 1 1 d . . . . .
 C4 C 0.4748(2) 0.59495(13) 0.48258(10) 0.0212(3) Uani 1 1 d . . . . .
 C5 C 0.4411(2) 0.69103(13) 0.44145(11) 0.0259(4) Uani 1 1 d . . . . .
 H5 H 0.344(3) 0.7394(16) 0.4637(12) 0.025(5) Uiso 1 1 d . . . . .
 C6 C 0.5405(3) 0.71678(14) 0.36943(11) 0.0272(4) Uani 1 1 d . . . . .
 H6 H 0.516(3) 0.7846(18) 0.3414(14) 0.036(6) Uiso 1 1 d . . . . .
 C7 C 0.6770(3) 0.64652(14) 0.33910(11) 0.0261(4) Uani 1 1 d . . . . .
 H7 H 0.746(3) 0.6583(16) 0.2881(12) 0.023(5) Uiso 1 1 d . . . . .
 C8 C 0.7165(2) 0.55105(13) 0.38035(11) 0.0242(4) Uani 1 1 d . . . . .
 H8 H 0.815(3) 0.5020(18) 0.3598(13) 0.033(6) Uiso 1 1 d . . . . .
 C9 C 0.6146(2) 0.52479(12) 0.45199(10) 0.0211(3) Uani 1 1 d . . . . .
 C10 C 0.6530(2) 0.57734(13) 0.65416(10) 0.0230(3) Uani 1 1 d . . . . .
 H10A H 0.717(3) 0.6211(17) 0.6124(14) 0.031(5) Uiso 1 1 d . . . . .
 H10B H 0.757(3) 0.5306(16) 0.6785(12) 0.022(5) Uiso 1 1 d . . . . .
 C11 C 0.5470(3) 0.64248(13) 0.72038(11) 0.0264(4) Uani 1 1 d . . . . .
 H11A H 0.633(3) 0.6643(16) 0.7679(13) 0.030(5) Uiso 1 1 d . . . . .
 H11B H 0.492(3) 0.7092(16) 0.6946(13) 0.028(5) Uiso 1 1 d . . . . .
 C12 C 0.3836(3) 0.57097(13) 0.74835(10) 0.0243(3) Uani 1 1 d . . . . .
 C13 C 0.3857(2) 0.46926(12) 0.69571(10) 0.0213(3) Uani 1 1 d . . . . .
 H13 H 0.463(3) 0.4157(16) 0.7245(12) 0.023(5) Uiso 1 1 d . . . . .
 C14 C 0.1917(2) 0.42239(14) 0.67785(11) 0.0252(4) Uani 1 1 d . . . . .
 H14 H 0.128(3) 0.3832(16) 0.7237(13) 0.037(6) Uiso 1 1 d . . . . .
 C15 C 0.1074(2) 0.43072(14) 0.60493(11) 0.0269(4) Uani 1 1 d . . . . .
 H15 H -0.020(3) 0.3959(18) 0.5955(13) 0.039(6) Uiso 1 1 d . . . . .
 C16 C 0.1926(2) 0.48954(15) 0.53281(11) 0.0261(4) Uani 1 1 d . . . . .
 H16A H 0.234(3) 0.4371(16) 0.4900(12) 0.025(5) Uiso 1 1 d . . . . .
 H16B H 0.096(3) 0.5368(18) 0.5061(14) 0.040(6) Uiso 1 1 d . . . . .
 C17 C 0.7439(3) 0.33918(14) 0.44919(12) 0.0305(4) Uani 1 1 d . . . . .
 H17A H 0.877(4) 0.3573(17) 0.4363(14) 0.038(6) Uiso 1 1 d . . . . .
 H17B H 0.739(4) 0.2766(19) 0.4832(15) 0.041(7) Uiso 1 1 d . . . . .
 H17C H 0.678(4) 0.3261(19) 0.3957(16) 0.047(7) Uiso 1 1 d . . . . .
 C18 C 0.2561(3) 0.59347(16) 0.80657(12) 0.0346(4) Uani 1 1 d . . . . .
 H18A H 0.150(4) 0.5415(18) 0.8200(14) 0.039(6) Uiso 1 1 d . . . . .
 H18B H 0.263(3) 0.6607(19) 0.8371(14) 0.038(6) Uiso 1 1 d . . . . .


_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 C1 1.225(2) . ?
 N1 C1 1.373(2) . ?
 N1 C9 1.422(2) . ?
 N1 C17 1.468(2) . ?
 C1 C2 1.519(2) . ?
 C2 C3 1.534(2) . ?
 C2 C10 1.549(2) . ?
 C2 C13 1.533(2) . ?
 C3 H3 0.978(19) . ?
 C3 C4 1.499(2) . ?
 C3 C16 1.542(2) . ?
 C4 C5 1.392(2) . ?
 C4 C9 1.401(2) . ?
 C5 H5 0.97(2) . ?
 C5 C6 1.391(3) . ?
 C6 H6 0.98(2) . ?
 C6 C7 1.385(3) . ?
 C7 H7 0.96(2) . ?
 C7 C8 1.394(2) . ?
 C8 H8 0.98(2) . ?
 C8 C9 1.396(2) . ?
 C10 H10A 0.97(2) . ?
 C10 H10B 1.01(2) . ?
 C10 C11 1.533(2) . ?
 C11 H11A 1.01(2) . ?
 C11 H11B 1.01(2) . ?
 C11 C12 1.518(2) . ?
 C12 C13 1.528(2) . ?
 C12 C18 1.324(3) . ?
 C13 H13 0.98(2) . ?
 C13 C14 1.503(2) . ?
 C14 H14 0.99(2) . ?
 C14 C15 1.319(3) . ?
 C15 H15 1.00(2) . ?
 C15 C16 1.499(2) . ?
 C16 H16A 0.99(2) . ?
 C16 H16B 1.00(2) . ?
 C17 H17A 0.98(3) . ?
 C17 H17B 0.96(2) . ?
 C17 H17C 0.99(3) . ?
 C18 H18A 1.01(2) . ?
 C18 H18B 0.98(2) . ?

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
 C1 N1 C9 122.50(13) . . ?
 C1 N1 C17 118.56(14) . . ?
 C9 N1 C17 118.94(14) . . ?
 O1 C1 N1 121.39(15) . . ?
 O1 C1 C2 122.28(15) . . ?
 N1 C1 C2 116.26(13) . . ?
 C1 C2 C3 109.48(13) . . ?
 C1 C2 C10 109.76(13) . . ?
 C1 C2 C13 112.77(13) . . ?
 C3 C2 C10 112.43(12) . . ?
 C13 C2 C3 110.07(13) . . ?
 C13 C2 C10 102.22(12) . . ?
 C2 C3 H3 106.7(11) . . ?
 C2 C3 C16 110.86(13) . . ?
 C4 C3 C2 109.25(13) . . ?
 C4 C3 H3 110.0(11) . . ?
 C4 C3 C16 110.85(13) . . ?
 C16 C3 H3 109.1(12) . . ?
 C5 C4 C3 122.56(15) . . ?
 C5 C4 C9 119.32(15) . . ?
 C9 C4 C3 118.09(14) . . ?
 C4 C5 H5 118.4(12) . . ?
 C6 C5 C4 120.87(16) . . ?
 C6 C5 H5 120.7(12) . . ?
 C5 C6 H6 120.0(14) . . ?
 C7 C6 C5 119.45(16) . . ?
 C7 C6 H6 120.5(14) . . ?
 C6 C7 H7 123.2(12) . . ?
 C6 C7 C8 120.67(16) . . ?
 C8 C7 H7 116.0(12) . . ?
 C7 C8 H8 120.9(13) . . ?
 C7 C8 C9 119.72(16) . . ?
 C9 C8 H8 119.4(13) . . ?
 C4 C9 N1 119.08(14) . . ?
 C8 C9 N1 120.96(14) . . ?
 C8 C9 C4 119.93(14) . . ?
 C2 C10 H10A 113.4(13) . . ?
 C2 C10 H10B 107.8(11) . . ?
 H10A C10 H10B 105.5(17) . . ?
 C11 C10 C2 104.02(13) . . ?
 C11 C10 H10A 113.8(13) . . ?
 C11 C10 H10B 112.5(11) . . ?
 C10 C11 H11A 112.6(12) . . ?
 C10 C11 H11B 109.6(12) . . ?
 H11A C11 H11B 108.5(16) . . ?
 C12 C11 C10 104.90(13) . . ?
 C12 C11 H11A 112.3(12) . . ?
 C12 C11 H11B 108.8(13) . . ?
 C11 C12 C13 108.49(14) . . ?
 C18 C12 C11 126.22(16) . . ?
 C18 C12 C13 125.26(16) . . ?
 C2 C13 H13 107.5(12) . . ?
 C12 C13 C2 103.41(12) . . ?
 C12 C13 H13 108.1(11) . . ?
 C14 C13 C2 113.88(13) . . ?
 C14 C13 C12 114.95(14) . . ?
 C14 C13 H13 108.6(12) . . ?
 C13 C14 H14 117.0(13) . . ?
 C15 C14 C13 122.81(16) . . ?
 C15 C14 H14 120.2(13) . . ?
 C14 C15 H15 119.8(13) . . ?
 C14 C15 C16 123.63(16) . . ?
 C16 C15 H15 116.6(13) . . ?
 C3 C16 H16A 109.9(12) . . ?
 C3 C16 H16B 106.9(13) . . ?
 C15 C16 C3 112.98(14) . . ?
 C15 C16 H16A 109.3(12) . . ?
 C15 C16 H16B 110.9(13) . . ?
 H16A C16 H16B 106.6(17) . . ?
 N1 C17 H17A 111.8(13) . . ?
 N1 C17 H17B 108.1(15) . . ?
 N1 C17 H17C 109.4(15) . . ?
 H17A C17 H17B 110(2) . . ?
 H17A C17 H17C 107(2) . . ?
 H17B C17 H17C 110(2) . . ?
 C12 C18 H18A 120.6(13) . . ?
 C12 C18 H18B 120.5(14) . . ?
 H18A C18 H18B 118.9(19) . . ?

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 C1 C2 C3 -143.18(15) . . . . ?
 O1 C1 C2 C10 92.97(18) . . . . ?
 O1 C1 C2 C13 -20.3(2) . . . . ?
 N1 C1 C2 C3 39.93(18) . . . . ?
 N1 C1 C2 C10 -83.92(16) . . . . ?
 N1 C1 C2 C13 162.83(14) . . . . ?
 C1 N1 C9 C4 -19.4(2) . . . . ?
 C1 N1 C9 C8 162.28(15) . . . . ?
 C1 C2 C3 C4 -56.38(16) . . . . ?
 C1 C2 C3 C16 66.06(16) . . . . ?
 C1 C2 C10 C11 -160.51(13) . . . . ?
 C1 C2 C13 C12 155.52(13) . . . . ?
 C1 C2 C13 C14 -79.03(16) . . . . ?
 C2 C3 C4 C5 -143.46(15) . . . . ?
 C2 C3 C4 C9 38.42(19) . . . . ?
 C2 C3 C16 C15 43.45(19) . . . . ?
 C2 C10 C11 C12 27.25(16) . . . . ?
 C2 C13 C14 C15 -14.1(2) . . . . ?
 C3 C2 C10 C11 77.38(16) . . . . ?
 C3 C2 C13 C12 -81.91(15) . . . . ?
 C3 C2 C13 C14 43.54(17) . . . . ?
 C3 C4 C5 C6 -176.42(16) . . . . ?
 C3 C4 C9 N1 -1.0(2) . . . . ?
 C3 C4 C9 C8 177.39(14) . . . . ?
 C4 C3 C16 C15 164.96(14) . . . . ?
 C4 C5 C6 C7 -1.0(3) . . . . ?
 C5 C4 C9 N1 -179.17(15) . . . . ?
 C5 C4 C9 C8 -0.8(2) . . . . ?
 C5 C6 C7 C8 -0.6(3) . . . . ?
 C6 C7 C8 C9 1.4(2) . . . . ?
 C7 C8 C9 N1 177.61(15) . . . . ?
 C7 C8 C9 C4 -0.7(2) . . . . ?
 C9 N1 C1 O1 -178.97(15) . . . . ?
 C9 N1 C1 C2 -2.1(2) . . . . ?
 C9 C4 C5 C6 1.7(2) . . . . ?
 C10 C2 C3 C4 65.89(16) . . . . ?
 C10 C2 C3 C16 -171.67(13) . . . . ?
 C10 C2 C13 C12 37.75(15) . . . . ?
 C10 C2 C13 C14 163.19(13) . . . . ?
 C10 C11 C12 C13 -3.61(17) . . . . ?
 C10 C11 C12 C18 178.37(18) . . . . ?
 C11 C12 C13 C2 -21.59(17) . . . . ?
 C11 C12 C13 C14 -146.34(15) . . . . ?
 C12 C13 C14 C15 104.97(18) . . . . ?
 C13 C2 C3 C4 179.13(13) . . . . ?
 C13 C2 C3 C16 -58.43(17) . . . . ?
 C13 C2 C10 C11 -40.60(15) . . . . ?
 C13 C14 C15 C16 -1.5(3) . . . . ?
 C14 C15 C16 C3 -13.7(2) . . . . ?
 C16 C3 C4 C5 94.10(18) . . . . ?
 C16 C3 C4 C9 -84.03(17) . . . . ?
 C17 N1 C1 O1 1.0(2) . . . . ?
 C17 N1 C1 C2 177.90(14) . . . . ?
 C17 N1 C9 C4 160.68(15) . . . . ?
 C17 N1 C9 C8 -17.7(2) . . . . ?
 C18 C12 C13 C2 156.45(17) . . . . ?
 C18 C12 C13 C14 31.7(2) . . . . ?

_olex2_exptl_crystal_mounting_method  'Mounted with alkane oil on plastic mesh.'
_olex2_submission_special_instructions  'No special instructions were received'
_vrf_PLAT791_bilm001
;
PROBLEM: Chirality 
RESPONSE: On close inspection of the connectivity and application 
of CIP rules, C2=S, C3=R, C13=R.
;
