#------------------------------------------------------------------------------
#$Date: 2016-03-21 04:40:09 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178476 $
#$URL: svn://www.crystallography.net/cod/cif/4/02/97/4029738.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_4029738
loop_
_publ_author_name
'Armstrong, David R.'
'Balloch, Liam'
'Hevia, Eva'
'Kennedy, Alan R.'
'Mulvey, Robert E.'
'O'Hara, Charles T'
'Robertson, Stuart D.'
_publ_section_title
;
 Meta-metallation of N,N-dimethylaniline: Contrasting direct
 sodium-mediated zincation with indirect sodiation-dialkylzinc
 co-complexation.
;
_journal_name_full               'Beilstein journal of organic chemistry'
_journal_page_first              1234
_journal_page_last               1248
_journal_paper_doi               10.3762/bjoc.7.144
_journal_volume                  7
_journal_year                    2011
_chemical_formula_moiety         'C28 H52 N6 Na2'
_chemical_formula_sum            'C28 H52 N6 Na2'
_chemical_formula_weight         518.74
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 111.693(12)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   8.8060(9)
_cell_length_b                   17.5089(12)
_cell_length_c                   11.1635(11)
_cell_measurement_reflns_used    3087
_cell_measurement_temperature    123(2)
_cell_measurement_theta_max      29.7303
_cell_measurement_theta_min      2.7422
_cell_volume                     1599.3(3)
_computing_cell_refinement
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.55 (release 05-01-2010 CrysAlis171 .NET)
(compiled Jan  5 2010,16:28:46)
;
_computing_data_collection
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.55 (release 05-01-2010 CrysAlis171 .NET)
(compiled Jan  5 2010,16:28:46)
;
_computing_data_reduction
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.55 (release 05-01-2010 CrysAlis171 .NET)
(compiled Jan  5 2010,16:28:46)
;
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      123(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.982
_diffrn_measurement_device_type  'Xcalibur, Sapphire3, Gemini'
_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  0.0454
_diffrn_reflns_av_sigmaI/netI    0.0691
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            8277
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         28.00
_diffrn_reflns_theta_min         2.75
_exptl_absorpt_coefficient_mu    0.088
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.81392
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.55 (release 05-01-2010 CrysAlis171 .NET)
(compiled Jan  5 2010,16:28:46)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.077
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       brick
_exptl_crystal_F_000             568
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.06
_refine_diff_density_max         0.233
_refine_diff_density_min         -0.161
_refine_diff_density_rms         0.044
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.905
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     169
_refine_ls_number_reflns         3797
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.905
_refine_ls_R_factor_all          0.0850
_refine_ls_R_factor_gt           0.0471
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0598P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1052
_refine_ls_wR_factor_ref         0.1133
_reflns_number_gt                2355
_reflns_number_total             3797
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            1860-5397-7-144-S2.txt
_cod_data_source_block           srlb1009
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4029738
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Na1 Na 0.42918(7) 0.06525(3) 0.39405(5) 0.02685(17) Uani 1 1 d .
C1 C 0.38817(19) 0.05055(8) 0.60683(14) 0.0260(3) Uani 1 1 d .
C2 C 0.21887(19) 0.05594(9) 0.57302(15) 0.0309(4) Uani 1 1 d .
H2A H 0.1525 0.0510 0.4843 0.037 Uiso 1 1 calc R
C3 C 0.1397(2) 0.06784(9) 0.65835(16) 0.0353(4) Uani 1 1 d .
H3A H 0.0238 0.0701 0.6282 0.042 Uiso 1 1 calc R
C4 C 0.2322(2) 0.07628(9) 0.78740(16) 0.0339(4) Uani 1 1 d .
H4A H 0.1808 0.0854 0.8473 0.041 Uiso 1 1 calc R
C5 C 0.40155(19) 0.07132(8) 0.82952(14) 0.0290(4) Uani 1 1 d .
H5A H 0.4663 0.0771 0.9185 0.035 Uiso 1 1 calc R
C6 C 0.47614(18) 0.05787(8) 0.74101(13) 0.0232(3) Uani 1 1 d .
N1 N 0.65046(16) 0.04387(7) 0.78638(12) 0.0300(3) Uani 1 1 d .
C7 C 0.7384(2) 0.08716(10) 0.72151(17) 0.0389(4) Uani 1 1 d .
H7A H 0.6775 0.0858 0.6282 0.058 Uiso 1 1 calc R
H7B H 0.8468 0.0646 0.7411 0.058 Uiso 1 1 calc R
H7C H 0.7503 0.1402 0.7515 0.058 Uiso 1 1 calc R
C8 C 0.7384(2) 0.04714(12) 0.92536(16) 0.0478(5) Uani 1 1 d .
H8A H 0.6888 0.0113 0.9678 0.072 Uiso 1 1 calc R
H8B H 0.7325 0.0991 0.9561 0.072 Uiso 1 1 calc R
H8C H 0.8530 0.0332 0.9457 0.072 Uiso 1 1 calc R
N2 N 0.22485(17) 0.16710(8) 0.27387(12) 0.0347(3) Uani 1 1 d .
N3 N 0.58756(16) 0.16568(7) 0.32500(12) 0.0318(3) Uani 1 1 d .
C10 C 0.3045(2) 0.21062(11) 0.20157(16) 0.0424(5) Uani 1 1 d .
H10A H 0.2415 0.2580 0.1691 0.051 Uiso 1 1 calc R
H10B H 0.3011 0.1802 0.1259 0.051 Uiso 1 1 calc R
C11 C 0.4793(2) 0.23165(9) 0.27842(17) 0.0394(4) Uani 1 1 d .
H11A H 0.5211 0.2636 0.2241 0.047 Uiso 1 1 calc R
H11B H 0.4828 0.2628 0.3534 0.047 Uiso 1 1 calc R
C12 C 0.0722(2) 0.13423(14) 0.1866(2) 0.0616(6) Uani 1 1 d .
H12A H 0.0943 0.1013 0.1239 0.092 Uiso 1 1 calc R
H12B H -0.0024 0.1753 0.1410 0.092 Uiso 1 1 calc R
H12C H 0.0221 0.1040 0.2360 0.092 Uiso 1 1 calc R
C13 C 0.1905(3) 0.21615(11) 0.36630(19) 0.0517(5) Uani 1 1 d .
H13A H 0.1382 0.1860 0.4144 0.078 Uiso 1 1 calc R
H13B H 0.1172 0.2575 0.3203 0.078 Uiso 1 1 calc R
H13C H 0.2929 0.2378 0.4264 0.078 Uiso 1 1 calc R
C14 C 0.6232(2) 0.12993(10) 0.22006(18) 0.0461(5) Uani 1 1 d .
H14A H 0.5214 0.1112 0.1546 0.069 Uiso 1 1 calc R
H14B H 0.6984 0.0871 0.2540 0.069 Uiso 1 1 calc R
H14C H 0.6736 0.1675 0.1812 0.069 Uiso 1 1 calc R
C15 C 0.7415(2) 0.18983(12) 0.42475(19) 0.0538(5) Uani 1 1 d .
H15A H 0.7193 0.2132 0.4964 0.081 Uiso 1 1 calc R
H15B H 0.7956 0.2271 0.3885 0.081 Uiso 1 1 calc R
H15C H 0.8127 0.1453 0.4562 0.081 Uiso 1 1 calc R
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'
Na Na 0.0362 0.0249 '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
N3 Na1 N2 73.37(5) . .
N3 Na1 C1 129.64(5) . .
N2 Na1 C1 104.31(5) . .
N3 Na1 C1 97.45(5) . 3_656
N2 Na1 C1 150.27(5) . 3_656
C1 Na1 C1 103.12(4) . 3_656
N3 Na1 N1 106.68(4) . 3_656
N2 Na1 N1 99.59(5) . 3_656
C1 Na1 N1 122.86(5) . 3_656
C1 Na1 N1 55.14(4) 3_656 3_656
N3 Na1 C6 93.49(4) . 3_656
N2 Na1 C6 121.84(5) . 3_656
C1 Na1 C6 124.95(5) . 3_656
C1 Na1 C6 28.94(4) 3_656 3_656
N1 Na1 C6 29.57(4) 3_656 3_656
N3 Na1 C7 134.70(5) . 3_656
N2 Na1 C7 104.49(5) . 3_656
C1 Na1 C7 95.26(5) . 3_656
C1 Na1 C7 61.58(5) 3_656 3_656
N1 Na1 C7 28.04(4) 3_656 3_656
C6 Na1 C7 48.04(4) 3_656 3_656
N3 Na1 Na1 127.85(4) . 3_656
N2 Na1 Na1 154.38(4) . 3_656
C1 Na1 Na1 52.21(4) . 3_656
C1 Na1 Na1 50.91(4) 3_656 3_656
N1 Na1 Na1 88.20(4) 3_656 3_656
C6 Na1 Na1 75.32(3) 3_656 3_656
C7 Na1 Na1 71.75(4) 3_656 3_656
C2 C1 C6 113.03(13) . .
C2 C1 Na1 104.24(10) . .
C6 C1 Na1 140.18(11) . .
C2 C1 Na1 130.76(11) . 3_656
C6 C1 Na1 88.69(9) . 3_656
Na1 C1 Na1 76.88(4) . 3_656
C3 C2 C1 125.45(14) . .
C3 C2 H2A 117.3 . .
C1 C2 H2A 117.3 . .
C4 C3 C2 118.78(15) . .
C4 C3 H3A 120.6 . .
C2 C3 H3A 120.6 . .
C3 C4 C5 119.55(14) . .
C3 C4 H4A 120.2 . .
C5 C4 H4A 120.2 . .
C4 C5 C6 119.88(14) . .
C4 C5 H5A 120.1 . .
C6 C5 H5A 120.1 . .
C5 C6 C1 123.27(14) . .
C5 C6 N1 119.79(13) . .
C1 C6 N1 116.72(12) . .
C5 C6 Na1 142.12(10) . 3_656
C1 C6 Na1 62.37(8) . 3_656
N1 C6 Na1 65.68(7) . 3_656
C6 N1 C7 115.37(12) . .
C6 N1 C8 116.31(13) . .
C7 N1 C8 109.80(14) . .
C6 N1 Na1 84.75(8) . 3_656
C7 N1 Na1 92.11(9) . 3_656
C8 N1 Na1 135.92(11) . 3_656
N1 C7 H7A 109.5 . .
N1 C7 H7B 109.5 . .
H7A C7 H7B 109.5 . .
N1 C7 H7C 109.5 . .
H7A C7 H7C 109.5 . .
H7B C7 H7C 109.5 . .
N1 C8 H8A 109.5 . .
N1 C8 H8B 109.5 . .
H8A C8 H8B 109.5 . .
N1 C8 H8C 109.5 . .
H8A C8 H8C 109.5 . .
H8B C8 H8C 109.5 . .
C12 N2 C13 108.96(15) . .
C12 N2 C10 110.42(14) . .
C13 N2 C10 110.54(14) . .
C12 N2 Na1 112.02(11) . .
C13 N2 Na1 109.40(10) . .
C10 N2 Na1 105.47(9) . .
C14 N3 C15 108.72(14) . .
C14 N3 C11 110.95(13) . .
C15 N3 C11 109.91(14) . .
C14 N3 Na1 104.59(10) . .
C15 N3 Na1 115.35(10) . .
C11 N3 Na1 107.21(10) . .
N2 C10 C11 114.25(13) . .
N2 C10 H10A 108.7 . .
C11 C10 H10A 108.7 . .
N2 C10 H10B 108.7 . .
C11 C10 H10B 108.7 . .
H10A C10 H10B 107.6 . .
N3 C11 C10 113.80(14) . .
N3 C11 H11A 108.8 . .
C10 C11 H11A 108.8 . .
N3 C11 H11B 108.8 . .
C10 C11 H11B 108.8 . .
H11A C11 H11B 107.7 . .
N2 C12 H12A 109.5 . .
N2 C12 H12B 109.5 . .
H12A C12 H12B 109.5 . .
N2 C12 H12C 109.5 . .
H12A C12 H12C 109.5 . .
H12B C12 H12C 109.5 . .
N2 C13 H13A 109.5 . .
N2 C13 H13B 109.5 . .
H13A C13 H13B 109.5 . .
N2 C13 H13C 109.5 . .
H13A C13 H13C 109.5 . .
H13B C13 H13C 109.5 . .
N3 C14 H14A 109.5 . .
N3 C14 H14B 109.5 . .
H14A C14 H14B 109.5 . .
N3 C14 H14C 109.5 . .
H14A C14 H14C 109.5 . .
H14B C14 H14C 109.5 . .
N3 C15 H15A 109.5 . .
N3 C15 H15B 109.5 . .
H15A C15 H15B 109.5 . .
N3 C15 H15C 109.5 . .
H15A C15 H15C 109.5 . .
H15B C15 H15C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Na1 N3 2.5350(14) .
Na1 N2 2.5363(14) .
Na1 C1 2.5442(15) .
Na1 C1 2.5903(16) 3_656
Na1 N1 2.6749(14) 3_656
Na1 C6 2.9231(15) 3_656
Na1 C7 3.0913(18) 3_656
Na1 Na1 3.1924(11) 3_656
C1 C2 1.399(2) .
C1 C6 1.415(2) .
C1 Na1 2.5903(16) 3_656
C2 C3 1.389(2) .
C2 H2A 0.9500 .
C3 C4 1.376(2) .
C3 H3A 0.9500 .
C4 C5 1.391(2) .
C4 H4A 0.9500 .
C5 C6 1.3940(19) .
C5 H5A 0.9500 .
C6 N1 1.4485(19) .
C6 Na1 2.9231(15) 3_656
N1 C7 1.454(2) .
N1 C8 1.457(2) .
N1 Na1 2.6749(14) 3_656
C7 H7A 0.9800 .
C7 H7B 0.9800 .
C7 H7C 0.9800 .
C8 H8A 0.9800 .
C8 H8B 0.9800 .
C8 H8C 0.9800 .
N2 C12 1.456(2) .
N2 C13 1.458(2) .
N2 C10 1.464(2) .
N3 C14 1.4610(19) .
N3 C15 1.463(2) .
N3 C11 1.465(2) .
C10 C11 1.505(2) .
C10 H10A 0.9900 .
C10 H10B 0.9900 .
C11 H11A 0.9900 .
C11 H11B 0.9900 .
C12 H12A 0.9800 .
C12 H12B 0.9800 .
C12 H12C 0.9800 .
C13 H13A 0.9800 .
C13 H13B 0.9800 .
C13 H13C 0.9800 .
C14 H14A 0.9800 .
C14 H14B 0.9800 .
C14 H14C 0.9800 .
C15 H15A 0.9800 .
C15 H15B 0.9800 .
C15 H15C 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_4
N3 Na1 C1 C2 119.30(10) . .
N2 Na1 C1 C2 39.21(11) . .
C1 Na1 C1 C2 -129.23(11) 3_656 .
N1 Na1 C1 C2 -72.48(11) 3_656 .
C6 Na1 C1 C2 -108.20(10) 3_656 .
C7 Na1 C1 C2 -67.22(10) 3_656 .
Na1 Na1 C1 C2 -129.23(11) 3_656 .
N3 Na1 C1 C6 -39.89(18) . .
N2 Na1 C1 C6 -119.98(16) . .
C1 Na1 C1 C6 71.57(15) 3_656 .
N1 Na1 C1 C6 128.33(15) 3_656 .
C6 Na1 C1 C6 92.60(16) 3_656 .
C7 Na1 C1 C6 133.58(16) 3_656 .
Na1 Na1 C1 C6 71.57(15) 3_656 .
N3 Na1 C1 Na1 -111.46(6) . 3_656
N2 Na1 C1 Na1 168.44(5) . 3_656
C1 Na1 C1 Na1 0.0 3_656 3_656
N1 Na1 C1 Na1 56.76(6) 3_656 3_656
C6 Na1 C1 Na1 21.03(6) 3_656 3_656
C7 Na1 C1 Na1 62.01(5) 3_656 3_656
C6 C1 C2 C3 0.5(2) . .
Na1 C1 C2 C3 -165.15(14) . .
Na1 C1 C2 C3 110.03(17) 3_656 .
C1 C2 C3 C4 0.9(3) . .
C2 C3 C4 C5 -1.2(2) . .
C3 C4 C5 C6 0.0(2) . .
C4 C5 C6 C1 1.6(2) . .
C4 C5 C6 N1 -172.82(13) . .
C4 C5 C6 Na1 -84.9(2) . 3_656
C2 C1 C6 C5 -1.8(2) . .
Na1 C1 C6 C5 156.23(13) . .
Na1 C1 C6 C5 -136.22(13) 3_656 .
C2 C1 C6 N1 172.80(12) . .
Na1 C1 C6 N1 -29.2(2) . .
Na1 C1 C6 N1 38.37(12) 3_656 .
C2 C1 C6 Na1 134.42(13) . 3_656
Na1 C1 C6 Na1 -67.55(13) . 3_656
C5 C6 N1 C7 -132.48(14) . .
C1 C6 N1 C7 52.73(18) . .
Na1 C6 N1 C7 89.85(11) 3_656 .
C5 C6 N1 C8 -1.7(2) . .
C1 C6 N1 C8 -176.52(14) . .
Na1 C6 N1 C8 -139.40(14) 3_656 .
C5 C6 N1 Na1 137.67(12) . 3_656
C1 C6 N1 Na1 -37.12(11) . 3_656
N3 Na1 N2 C12 137.37(13) . .
C1 Na1 N2 C12 -94.97(12) . .
C1 Na1 N2 C12 61.86(16) 3_656 .
N1 Na1 N2 C12 32.70(12) 3_656 .
C6 Na1 N2 C12 53.73(13) 3_656 .
C7 Na1 N2 C12 4.45(13) 3_656 .
Na1 Na1 N2 C12 -73.49(16) 3_656 .
N3 Na1 N2 C13 -101.69(11) . .
C1 Na1 N2 C13 25.97(12) . .
C1 Na1 N2 C13 -177.20(11) 3_656 .
N1 Na1 N2 C13 153.63(11) 3_656 .
C6 Na1 N2 C13 174.66(10) 3_656 .
C7 Na1 N2 C13 125.38(11) 3_656 .
Na1 Na1 N2 C13 47.44(17) 3_656 .
N3 Na1 N2 C10 17.22(10) . .
C1 Na1 N2 C10 144.88(10) . .
C1 Na1 N2 C10 -58.29(16) 3_656 .
N1 Na1 N2 C10 -87.46(11) 3_656 .
C6 Na1 N2 C10 -66.43(11) 3_656 .
C7 Na1 N2 C10 -115.70(10) 3_656 .
Na1 Na1 N2 C10 166.36(11) 3_656 .
N2 Na1 N3 C14 -106.91(11) . .
C1 Na1 N3 C14 158.05(10) . .
C1 Na1 N3 C14 44.13(11) 3_656 .
N1 Na1 N3 C14 -11.63(11) 3_656 .
C6 Na1 N3 C14 15.32(11) 3_656 .
C7 Na1 N3 C14 -12.79(13) 3_656 .
Na1 Na1 N3 C14 89.40(11) 3_656 .
N2 Na1 N3 C15 133.72(12) . .
C1 Na1 N3 C15 38.69(14) . .
C1 Na1 N3 C15 -75.23(12) 3_656 .
N1 Na1 N3 C15 -130.99(12) 3_656 .
C6 Na1 N3 C15 -104.05(12) 3_656 .
C7 Na1 N3 C15 -132.15(12) 3_656 .
Na1 Na1 N3 C15 -29.96(13) 3_656 .
N2 Na1 N3 C11 10.95(10) . .
C1 Na1 N3 C11 -84.08(12) . .
C1 Na1 N3 C11 162.00(10) 3_656 .
N1 Na1 N3 C11 106.24(10) 3_656 .
C6 Na1 N3 C11 133.18(10) 3_656 .
C7 Na1 N3 C11 105.08(11) 3_656 .
Na1 Na1 N3 C11 -152.73(9) 3_656 .
C12 N2 C10 C11 -166.78(15) . .
C13 N2 C10 C11 72.57(18) . .
Na1 N2 C10 C11 -45.57(16) . .
C14 N3 C11 C10 74.47(18) . .
C15 N3 C11 C10 -165.26(13) . .
Na1 N3 C11 C10 -39.18(15) . .
N2 C10 C11 N3 62.11(19) . .
