# Supplementary Material (ESI) for Journal of Materials Chemistry
# This journal is (C) The Royal Society of Chemistry 2007


data_global
_journal_name_full               J.Mater.Chem.

_journal_coden_Cambridge         1145

_publ_contact_author_name        'W.G. Skene'
_publ_contact_author_address     
;
Department of Chemistry
University of Montreal
CP 6128
Succ Centre-Ville
Montreal
Quebec
H3C 3J7
CANADA
;

_publ_contact_author_email       W.SKENE@UMONTREAL.CA

_publ_section_title              
;
Photophysical, Electrochemical, and Crystallographic
Investigation of Conjugated Fluoreno Azomethines and Their Precursors
;
loop_
_publ_author_name
'W.G. Skene'
'Stephane Dufresne'
'Sergio Andres Perez Guarin'
'Assa Sylla'
'Derek Tsang'

data_sken25
_database_code_depnum_ccdc_archive 'CCDC 630800'

_cell_formula_units_Z            ?
#Added by publCIF

_audit_update_record             
;
2007-03-25 # Formatted by publCIF
;
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_symmetry_Int_Tables_number      2
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 x,y,z
2 -x,-y,-z
_cell_length_a                   13.5680(9)
_cell_length_b                   14.9070(10)
_cell_length_c                   24.0773(18)
_cell_angle_alpha                76.898(3)
_cell_angle_beta                 74.505(2)
_cell_angle_gamma                77.736(2)
_cell_volume                     4510.45
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
N12 N 0.81092(13) 0.09525(12) 0.83114(8)
N11 N 1.09694(12) 0.34968(12) 1.16337(7)
C11 C 1.10880(15) 0.34305(16) 1.37501(9)
H11A H 1.0940 0.2793 1.3930
H11B H 1.0461 0.3888 1.3866
C12 C 1.20081(15) 0.36192(14) 1.39264(9)
C13 C 1.21634(17) 0.35817(15) 1.44797(10)
H13 H 1.1630 0.3454 1.4820
C14 C 1.31158(18) 0.37344(16) 1.45280(11)
H14 H 1.3232 0.3701 1.4905
C15 C 1.38987(18) 0.39346(16) 1.40297(11)
H15 H 1.4541 0.4037 1.4071
C16 C 1.37476(16) 0.39859(15) 1.34729(10)
H16 H 1.4278 0.4131 1.3134
C17 C 1.27998(14) 0.38202(13) 1.34213(9)
C18 C 1.24467(14) 0.37785(13) 1.29042(9)
C19 C 1.29355(15) 0.39408(13) 1.23072(9)
H19 H 1.3613 0.4098 1.2183
C110 C 1.24128(15) 0.38674(13) 1.18998(9)
H110 H 1.2726 0.4000 1.1494
C111 C 1.14275(15) 0.35999(13) 1.20797(9)
C112 C 1.09332(15) 0.34424(14) 1.26777(9)
H112 H 1.0261 0.3273 1.2800
C113 C 1.14410(14) 0.35376(13) 1.30881(9)
C140 C 1.06218(14) 0.27267(14) 1.17081(9)
H140 H 1.0658 0.2291 1.2060
C114 C 0.91777(13) 0.33607(12) 0.98404(8)
C115 C 0.95552(13) 0.28162(12) 1.03931(8)
C116 C 0.99156(13) 0.31255(13) 1.07875(8)
H116 H 0.9990 0.3762 1.0729
C117 C 1.01757(14) 0.24827(14) 1.12837(8)
C118 C 1.00521(14) 0.15476(13) 1.13682(9)
H118 H 1.0212 0.1125 1.1704
C119 C 0.96977(14) 0.12286(13) 1.09676(8)
H119 H 0.9623 0.0592 1.1025
C120 C 0.94531(13) 0.18631(13) 1.04787(8)
C121 C 0.91040(13) 0.17127(12) 0.99891(8)
C122 C 0.89051(14) 0.08864(13) 0.98837(9)
H122 H 0.8963 0.0323 1.0161
C123 C 0.86234(14) 0.09073(13) 0.93704(9)
H123 H 0.8482 0.0353 0.9297
C124 C 0.85412(13) 0.17422(13) 0.89497(9)
C125 C 0.87108(13) 0.25773(12) 0.90706(8)
H125 H 0.8643 0.3143 0.8797
C126 C 0.89786(13) 0.25655(12) 0.95936(8)
C127 C 0.70270(15) -0.09874(14) 0.71914(9)
H12A H 0.6295 -0.1000 0.7404
H12B H 0.7455 -0.1585 0.7322
C128 C 0.74200(14) -0.01612(13) 0.72828(9)
C129 C 0.75468(15) 0.00375(14) 0.77927(9)
H129 H 0.7369 -0.0374 0.8155
C130 C 0.79394(15) 0.08490(14) 0.77748(9)
C131 C 0.81880(16) 0.14619(14) 0.72315(9)
H131 H 0.8443 0.2015 0.7217
C132 C 0.80634(15) 0.12618(14) 0.67213(9)
H132 H 0.8232 0.1676 0.6359
C133 C 0.76862(14) 0.04424(13) 0.67426(9)
C134 C 0.75264(14) 0.00440(13) 0.62754(9)
C135 C 0.77291(15) 0.03459(14) 0.56648(9)
H135 H 0.7993 0.0912 0.5492
C136 C 0.75393(16) -0.01936(15) 0.53194(10)
H136 H 0.7678 0.0002 0.4906
C137 C 0.71457(17) -0.10230(15) 0.55712(10)
H137 H 0.7015 -0.1383 0.5328
C138 C 0.69419(15) -0.13298(14) 0.61804(10)
H138 H 0.6673 -0.1894 0.6350
C139 C 0.71378(14) -0.08004(13) 0.65295(9)
C141 C 0.83003(14) 0.17137(13) 0.83966(9)
H141 H 0.8285 0.2257 0.8101
C142 C 0.81500(14) 0.40162(13) 1.00631(8)
H14A H 0.7705 0.3639 1.0386
H14B H 0.8325 0.4494 1.0231
C143 C 0.75072(15) 0.45239(14) 0.96121(9)
H14C H 0.7126 0.4081 0.9540
H14D H 0.7979 0.4746 0.9237
C144 C 0.67249(14) 0.53656(14) 0.98254(8)
H14E H 0.7116 0.5844 0.9844
H14F H 0.6302 0.5644 0.9533
C145 C 0.59961(14) 0.51230(13) 1.04255(8)
H14G H 0.5584 0.4664 1.0403
H14H H 0.6418 0.4823 1.0716
C146 C 0.52534(14) 0.59668(13) 1.06416(8)
H14I H 0.5656 0.6462 1.0616
H14J H 0.4765 0.6217 1.0382
C147 C 0.46349(14) 0.57247(13) 1.12734(8)
H14K H 0.4127 0.5332 1.1280
H14L H 0.5116 0.5349 1.1516
C148 C 0.40548(15) 0.65723(14) 1.15519(9)
H14M H 0.4542 0.7012 1.1495
H14N H 0.3500 0.6896 1.1347
C149 C 0.35731(17) 0.63217(15) 1.22064(9)
H14O H 0.3040 0.5935 1.2265
H14P H 0.3258 0.6895 1.2364
H14Q H 0.4112 0.5975 1.2411
C150 C 0.99785(14) 0.39484(12) 0.94097(8)
H15A H 0.9686 0.4283 0.9070
H15B H 1.0077 0.4424 0.9609
C151 C 1.10393(14) 0.33901(13) 0.91824(9)
H15C H 1.0960 0.2958 0.8945
H15D H 1.1315 0.3011 0.9519
C152 C 1.18145(14) 0.40313(13) 0.88064(9)
H15E H 1.1524 0.4424 0.8479
H15F H 1.1902 0.4452 0.9048
C153 C 1.28824(14) 0.34978(14) 0.85547(9)
H15G H 1.3382 0.3942 0.8406
H15H H 1.3119 0.3029 0.8875
C154 C 1.29022(13) 0.30041(13) 0.80622(8)
H15I H 1.2671 0.3472 0.7739
H15J H 1.2404 0.2558 0.8209
C155 C 1.39756(14) 0.24765(14) 0.78208(9)
H15K H 1.4467 0.2928 0.7669
H15L H 1.4211 0.2022 0.8148
C156 C 1.40237(15) 0.19560(15) 0.73355(9)
H15M H 1.3963 0.2413 0.6972
H15N H 1.3429 0.1613 0.7449
C157 C 1.50335(17) 0.12658(18) 0.72152(12)
H15O H 1.5624 0.1602 0.7102
H15P H 1.5039 0.0955 0.6896
H15Q H 1.5084 0.0798 0.7570
H22B H -0.1019 0.8600 0.3538
H229 H -0.1494 0.7666 0.2712
H230 H -0.0589 0.6558 0.2131
H238 H -0.0805 0.8559 0.4716
H331 H -0.1281 0.7268 0.2420
H332 H -0.1321 0.8032 0.3181
H335 H -0.0949 0.8642 0.4108
H336 H -0.0242 0.8888 0.4863
H341 H -0.0007 0.8477 0.5712
H24K H 0.5998 1.1690 0.5258
H24L H 0.5426 1.2075 0.4735
H29A H 0.4811 1.3498 0.5170
H29B H 0.5994 1.3323 0.4807
H29C H 0.5380 1.2701 0.6041
H29D H 0.6546 1.2639 0.5668
H29E H 0.6418 1.4212 0.5542
H29F H 0.6165 1.3748 0.6222
H29G H 0.5242 1.4280 0.5912

_refine_special_details          
;
Owing the extreme disorder of one of the molecules within the lattice, some
restraints were imposed in order to achieve a good correlation with the final
structural refinement. Some optimized parameters within standard deviation
from the ordered molecule were consequently applied to the disordered molecule
in order to achieve the refined structure. Identical anisotropic displacement
parameters were restrained for every atom of the disordered molecule. Separate
anisotropic displacement parameters were applied while some bond lengths such
as the azomethine were restrained in the disordered molecule as to achieve a
good correlation factor.
;
#END