##############################################################################
###                                                                        ###
###           Full Paper (Acta Crystallographica Section C)                ###
###                                                                        ###
##############################################################################
#                                                                            #
# This CIF contains the data in a paper accepted for publication in Acta     #
# Crystallographica Section C. It conforms to the editorial and technical    #
# requirements of Notes for Authors for Section C, and has been peer         #
# reviewed under the auspices of the IUCr Commission on Journals.            #
#                                                                            #
# Full details of the Crystallographic Information File format               #
# are given in the paper "The Crystallographic Information File (CIF):       #
# a New Standard Archive File for Crystallography" by S. R. Hall, F. H.      #
# Allen and I. D. Brown [Acta Cryst. (1991), A47, 655-685].                  #
#                                                                            #
# The current version of the core CIF dictionary is obtainable from          #
# ftp://ftp.iucr.org/pub/cif_core.dic. The current version number is 2.1.    #
#                                                                            #
# Software is freely available for graphical display of the structure(s) in  #
# this CIF.  For information consult the CIF home page http://www.iucr.org/  #
# cif/home.html                                                              #
#                                                                            #
#            Copyright International Union of Crystallography                #
#                                                                            #
##############################################################################
data_I
_audit_creation_method     SHELXL97
_chemical_name_systematic
;
(methanol)[10,15,20-tris(4-cyanophenyl)-5-(4-pyridyl)porphyrinato]zinc(II)
;
_chemical_name_common     ?
_chemical_formula_moiety     'C47 H28 N8 O Zn'
_chemical_formula_sum     'C47 H28 N8 O Zn'
_chemical_formula_iupac     '[Zn (C46 H24 N8) (C1 H4 O1)]'
_chemical_formula_weight     786.14
_chemical_melting_point     ?
_symmetry_cell_setting     'monoclinic'
_symmetry_space_group_name_H-M     'P n'
_symmetry_space_group_name_Hall     'P -2yac'
loop_
    _symmetry_equiv_pos_as_xyz
    'x, y, z'
    'x+1/2, -y, z+1/2'
_cell_length_a     9.2505(4)
_cell_length_b     9.6600(5)
_cell_length_c     21.1032(10)
_cell_angle_alpha     90.00
_cell_angle_beta     101.422(3)
_cell_angle_gamma     90.00
_cell_volume     1848.43(15)
_cell_formula_units_Z     2
_cell_measurement_reflns_used     4371
_cell_measurement_theta_min     1.41
_cell_measurement_theta_max     27.88
_cell_measurement_temperature     110(2)
_exptl_crystal_description     'prism'
_exptl_crystal_colour     'red'
_exptl_crystal_size_max     0.30
_exptl_crystal_size_mid     0.20
_exptl_crystal_size_min     0.20
_exptl_crystal_density_diffrn     1.412
_exptl_crystal_density_meas     ?
_exptl_crystal_density_method     'not measured'
_exptl_crystal_F_000     808
_exptl_absorpt_coefficient_mu     0.715
_exptl_absorpt_correction_type     none
_exptl_absorpt_process_details     ?
_exptl_absorpt_correction_T_min     ?
_exptl_absorpt_correction_T_max     ?
_exptl_special_details
;
 ?
;
_diffrn_ambient_temperature     110(2)
_diffrn_radiation_type     MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_source     'fine-focus sealed tube'
_diffrn_radiation_monochromator     graphite
_diffrn_measurement_device_type     'Nonius KappaCCD area-detector'
_diffrn_measurement_method     '1° φ and ω'
_diffrn_detector_area_resol_mean     12.8
_diffrn_reflns_number     17749
_diffrn_reflns_av_R_equivalents     0.0323
_diffrn_reflns_av_sigmaI/netI     0.0546
_diffrn_reflns_theta_min     2.11
_diffrn_reflns_theta_max     27.90
_diffrn_reflns_theta_full     27.90
_diffrn_measured_fraction_theta_max     0.995
_diffrn_measured_fraction_theta_full     0.995
_diffrn_reflns_limit_h_min     -12
_diffrn_reflns_limit_h_max     12
_diffrn_reflns_limit_k_min     -12
_diffrn_reflns_limit_k_max     10
_diffrn_reflns_limit_l_min     -27
_diffrn_reflns_limit_l_max     27
_diffrn_standards_number     0
_diffrn_standards_interval_count     ?
_diffrn_standards_interval_time     ?
_diffrn_standards_decay_%     ?
_refine_special_details
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;
_reflns_number_total     7371
_reflns_number_gt     6328
_reflns_threshold_expression     I>2σ(I)
_refine_ls_structure_factor_coef     Fsqd
_refine_ls_matrix_type     full
_refine_ls_R_factor_all     0.0779
_refine_ls_R_factor_gt     0.0632
_refine_ls_wR_factor_gt     0.1320
_refine_ls_wR_factor_ref     0.1389
_refine_ls_goodness_of_fit_ref     1.112
_refine_ls_restrained_S_all     1.112
_refine_ls_number_reflns     7371
_refine_ls_number_parameters     517
_refine_ls_number_restraints     2
_refine_ls_hydrogen_treatment     constr
_refine_ls_weighting_scheme     calc
_refine_ls_weighting_details
        'calc w = 1/[σ²(Fo²)+(0.0348P)²+3.736P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary     difmap
_refine_ls_shift/su_max     0.013
_refine_ls_shift/su_mean     0.002
_refine_diff_density_max     0.827
_refine_diff_density_min     -1.547
_refine_ls_extinction_method     none
_refine_ls_extinction_coef     ?
_refine_ls_abs_structure_details     'Flack (1983), with 2936 Friedel pairs'
_refine_ls_abs_structure_Flack     0.381(17)
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'
    'Zn' 'Zn' 0.2839 1.4301
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
_computing_data_collection     'COLLECT (Nonius, 1999)'
_computing_cell_refinement     'DENZO (Otwinowski & Minor, 1997)'
_computing_data_reduction     'DENZO'
_computing_structure_solution     'SIR97 (Altomare et al.,  1994)'
_computing_structure_refinement     'SHELXL97 (Sheldrick, 1997)'
_computing_molecular_graphics
;
ORTEPIII (Burnett & Johnson, 1996) and
MERCURY (Macrae et al.,  2006)
;
_computing_publication_material     SHELXL97
loop_
    _atom_site_type_symbol
    _atom_site_label
    _atom_site_fract_x
    _atom_site_fract_y
    _atom_site_fract_z
    _atom_site_U_iso_or_equiv
    _atom_site_adp_type
    _atom_site_calc_flag
    _atom_site_refinement_flags
    _atom_site_occupancy
    _atom_site_disorder_assembly
    _atom_site_disorder_group
    Zn Zn 0.79964(9) 0.23826(6) 0.58572(5) 0.03553(17) Uani d . 1 . .
    C C1 0.7068(6) 0.4362(5) 0.6854(3) 0.0248(11) Uani d . 1 . .
    C C2 0.7066(6) 0.4488(5) 0.7539(3) 0.0293(12) Uani d . 1 . .
    H H2 0.6673 0.5230 0.7747 0.035 Uiso calc R 1 . .
    C C3 0.7743(6) 0.3327(5) 0.7823(3) 0.0287(12) Uani d . 1 . .
    H H3 0.7915 0.3115 0.8272 0.034 Uiso calc R 1 . .
    C C4 0.8147(7) 0.2489(5) 0.7329(3) 0.0284(15) Uani d . 1 . .
    C C5 0.8912(6) 0.1254(5) 0.7428(3) 0.0246(11) Uani d . 1 . .
    C C6 0.9360(6) 0.0429(5) 0.6947(3) 0.0257(11) Uani d . 1 . .
    C C7 1.0234(6) -0.0836(5) 0.7093(3) 0.0287(12) Uani d . 1 . .
    H H7 1.0584 -0.1244 0.7504 0.034 Uiso calc R 1 . .
    C C8 1.0435(6) -0.1300(5) 0.6504(3) 0.0291(12) Uani d . 1 . .
    H H8 1.0934 -0.2124 0.6427 0.035 Uiso calc R 1 . .
    C C9 0.9771(6) -0.0341(5) 0.6030(3) 0.0267(11) Uani d . 1 . .
    C C10 0.9802(6) -0.0417(5) 0.5362(3) 0.0289(12) Uani d . 1 . .
    C C11 0.9278(6) 0.0580(5) 0.4897(3) 0.0299(12) Uani d . 1 . .
    C C12 0.9339(7) 0.0494(6) 0.4211(3) 0.0335(13) Uani d . 1 . .
    H H12 0.9767 -0.0231 0.4006 0.040 Uiso calc R 1 . .
    C C13 0.8676(7) 0.1636(5) 0.3924(3) 0.0330(13) Uani d . 1 . .
    H H13 0.8553 0.1867 0.3479 0.040 Uiso calc R 1 . .
    C C14 0.8181(7) 0.2453(5) 0.4421(4) 0.0291(15) Uani d . 1 . .
    C C15 0.7442(6) 0.3714(5) 0.4317(3) 0.0274(12) Uani d . 1 . .
    C C16 0.7003(6) 0.4536(5) 0.4788(3) 0.0263(11) Uani d . 1 . .
    C C17 0.6250(6) 0.5820(5) 0.4676(3) 0.0284(12) Uani d . 1 . .
    H H17 0.5972 0.6262 0.4268 0.034 Uiso calc R 1 . .
    C C18 0.5992(6) 0.6312(6) 0.5237(3) 0.0295(12) Uani d . 1 . .
    H H18 0.5499 0.7147 0.5302 0.035 Uiso calc R 1 . .
    C C19 0.6630(6) 0.5294(5) 0.5730(3) 0.0246(11) Uani d . 1 . .
    C C20 0.6526(6) 0.5377(5) 0.6384(3) 0.0257(11) Uani d . 1 . .
    N N21 0.7734(5) 0.3145(4) 0.6740(2) 0.0268(10) Uani d . 1 . .
    N N22 0.9082(5) 0.0702(4) 0.6308(2) 0.0255(10) Uani d . 1 . .
    N N23 0.8575(5) 0.1779(4) 0.5005(2) 0.0272(10) Uani d . 1 . .
    N N24 0.7223(5) 0.4219(4) 0.5441(2) 0.0265(10) Uani d . 1 . .
    C C25 0.9298(6) 0.0718(5) 0.8118(3) 0.0241(11) Uani d . 1 . .
    C C26 1.0556(7) 0.1183(6) 0.8535(3) 0.0345(13) Uani d . 1 . .
    H H26 1.1199 0.1827 0.8391 0.041 Uiso calc R 1 . .
    C C27 1.0858(7) 0.0690(6) 0.9165(3) 0.0379(14) Uani d . 1 . .
    H H27 1.1704 0.1035 0.9452 0.045 Uiso calc R 1 . .
    N N28 1.0019(6) -0.0247(5) 0.9391(2) 0.0346(11) Uani d . 1 . .
    C C29 0.8804(7) -0.0722(6) 0.8974(3) 0.0361(14) Uani d . 1 . .
    H H29 0.8196 -0.1394 0.9120 0.043 Uiso calc R 1 . .
    C C30 0.8430(7) -0.0247(6) 0.8339(3) 0.0355(13) Uani d . 1 . .
    H H30 0.7573 -0.0592 0.8059 0.043 Uiso calc R 1 . .
    C C31 1.0566(6) -0.1668(5) 0.5150(3) 0.0257(12) Uani d . 1 . .
    C C32 1.0001(7) -0.2995(7) 0.5207(3) 0.0318(14) Uani d . 1 . .
    H H32 0.9158 -0.3117 0.5395 0.038 Uiso calc R 1 . .
    C C33 1.0683(7) -0.4146(6) 0.4985(3) 0.0341(13) Uani d . 1 . .
    H H33 1.0333 -0.5054 0.5041 0.041 Uiso calc R 1 . .
    C C34 1.1882(7) -0.3946(6) 0.4680(3) 0.0332(13) Uani d . 1 . .
    C C35 1.2424(7) -0.2638(6) 0.4623(3) 0.0323(14) Uani d . 1 . .
    H H35 1.3248 -0.2513 0.4422 0.039 Uiso calc R 1 . .
    C C36 1.1777(6) -0.1492(6) 0.4856(3) 0.0277(12) Uani d . 1 . .
    H H36 1.2161 -0.0592 0.4815 0.033 Uiso calc R 1 . .
    C C37 1.2446(7) -0.5131(6) 0.4387(3) 0.0384(14) Uani d . 1 . .
    N N38 1.2884(7) -0.6051(6) 0.4128(3) 0.0499(16) Uani d . 1 . .
    C C39 0.7138(6) 0.4263(5) 0.3644(3) 0.0295(12) Uani d . 1 . .
    C C40 0.5869(6) 0.3855(6) 0.3205(3) 0.0327(13) Uani d . 1 . .
    H H40 0.5207 0.3209 0.3332 0.039 Uiso calc R 1 . .
    C C41 0.5579(7) 0.4396(6) 0.2580(3) 0.0363(14) Uani d . 1 . .
    H H41 0.4714 0.4125 0.2283 0.044 Uiso calc R 1 . .
    C C42 0.6555(7) 0.5331(5) 0.2392(3) 0.0316(13) Uani d . 1 . .
    C C43 0.7786(9) 0.5736(7) 0.2812(3) 0.0439(17) Uani d . 1 . .
    H H43 0.8447 0.6375 0.2678 0.053 Uiso calc R 1 . .
    C C44 0.8080(7) 0.5219(5) 0.3437(3) 0.0345(13) Uani d . 1 . .
    H H44 0.8938 0.5519 0.3730 0.041 Uiso calc R 1 . .
    C C45 0.6269(7) 0.5892(6) 0.1743(3) 0.0459(15) Uani d . 1 . .
    N N46 0.6023(7) 0.6327(5) 0.1210(3) 0.0512(14) Uani d . 1 . .
    C C47 0.5832(6) 0.6618(6) 0.6604(3) 0.0259(13) Uani d . 1 . .
    C C48 0.6392(6) 0.7950(5) 0.6548(3) 0.0270(12) Uani d . 1 . .
    H H48 0.7215 0.8072 0.6347 0.032 Uiso calc R 1 . .
    C C49 0.5758(6) 0.9092(6) 0.6784(3) 0.0314(12) Uani d . 1 . .
    H H49 0.6131 0.9994 0.6735 0.038 Uiso calc R 1 . .
    C C50 0.4587(7) 0.8915(6) 0.7089(3) 0.0282(13) Uani d . 1 . .
    C C51 0.3980(6) 0.7600(6) 0.7134(3) 0.0288(13) Uani d . 1 . .
    H H51 0.3152 0.7484 0.7333 0.035 Uiso calc R 1 . .
    C C52 0.4603(6) 0.6469(6) 0.6883(3) 0.0295(12) Uani d . 1 . .
    H H52 0.4181 0.5577 0.6903 0.035 Uiso calc R 1 . .
    C C53 0.3967(7) 1.0081(6) 0.7366(3) 0.0378(14) Uani d . 1 . .
    N N54 0.3550(7) 1.1013(6) 0.7606(3) 0.0566(17) Uani d . 1 . .
    O O55 0.5795(4) 0.1371(4) 0.56084(19) 0.0350(9) Uani d . 1 . .
    H H55 0.5479 0.0928 0.5174 0.023(13) Uiso d R 1 . .
    C C56 0.4487(7) 0.2068(7) 0.5745(3) 0.0520(16) Uani d . 1 . .
    H H56A 0.4717 0.2474 0.6179 0.078 Uiso calc R 1 . .
    H H56B 0.3684 0.1396 0.5723 0.078 Uiso calc R 1 . .
    H H56C 0.4182 0.2801 0.5426 0.078 Uiso calc R 1 . .
_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_site_symmetry_2
    _geom_bond_distance
    _geom_bond_publ_flag
    Zn N21 . 2.062(5) yes
    Zn N22 . 2.042(4) yes
    Zn N23 . 2.059(4) yes
    Zn N24 . 2.044(4) yes
    Zn O55 . 2.226(4) yes
    Zn N46 2_565 3.020(6) yes
    C1 N21 . 1.371(6) ?
    C1 C20 . 1.415(7) ?
    C1 C2 . 1.450(8) ?
    C2 C3 . 1.364(8) ?
    C2 H2 . 0.9500 ?
    C3 C4 . 1.428(8) ?
    C3 H3 . 0.9500 ?
    C4 N21 . 1.380(8) ?
    C4 C5 . 1.382(7) ?
    C5 C6 . 1.414(7) ?
    C5 C25 . 1.521(7) ?
    C6 N22 . 1.348(7) ?
    C6 C7 . 1.464(7) ?
    C7 C8 . 1.368(8) ?
    C7 H7 . 0.9500 ?
    C8 C9 . 1.412(8) ?
    C8 H8 . 0.9500 ?
    C9 N22 . 1.384(6) ?
    C9 C10 . 1.418(8) ?
    C10 C11 . 1.392(8) ?
    C10 C31 . 1.512(7) ?
    C11 N23 . 1.370(7) ?
    C11 C12 . 1.461(8) ?
    C12 C13 . 1.346(8) ?
    C12 H12 . 0.9500 ?
    C13 C14 . 1.455(9) ?
    C13 H13 . 0.9500 ?
    C14 N23 . 1.378(8) ?
    C14 C15 . 1.393(7) ?
    C15 C16 . 1.393(7) ?
    C15 C39 . 1.489(8) ?
    C16 N24 . 1.388(7) ?
    C16 C17 . 1.420(7) ?
    C17 C18 . 1.339(8) ?
    C17 H17 . 0.9500 ?
    C18 C19 . 1.467(8) ?
    C18 H18 . 0.9500 ?
    C19 N24 . 1.372(7) ?
    C19 C20 . 1.404(8) ?
    C20 C47 . 1.478(8) ?
    C25 C30 . 1.371(8) ?
    C25 C26 . 1.387(8) ?
    C26 C27 . 1.389(9) ?
    C26 H26 . 0.9500 ?
    C27 N28 . 1.339(8) ?
    C27 H27 . 0.9500 ?
    N28 C29 . 1.362(8) ?
    C29 C30 . 1.393(9) ?
    C29 H29 . 0.9500 ?
    C30 H30 . 0.9500 ?
    C31 C36 . 1.395(8) ?
    C31 C32 . 1.398(9) ?
    C32 C33 . 1.404(8) ?
    C32 H32 . 0.9500 ?
    C33 C34 . 1.402(9) ?
    C33 H33 . 0.9500 ?
    C34 C35 . 1.374(8) ?
    C34 C37 . 1.447(8) ?
    C35 C36 . 1.393(8) ?
    C35 H35 . 0.9500 ?
    C36 H36 . 0.9500 ?
    C37 N38 . 1.158(8) ?
    C39 C44 . 1.398(8) ?
    C39 C40 . 1.401(8) ?
    C40 C41 . 1.394(8) ?
    C40 H40 . 0.9500 ?
    C41 C42 . 1.389(9) ?
    C41 H41 . 0.9500 ?
    C42 C43 . 1.355(10) ?
    C42 C45 . 1.448(8) ?
    C43 C44 . 1.386(9) ?
    C43 H43 . 0.9500 ?
    C44 H44 . 0.9500 ?
    C45 N46 . 1.180(7) ?
    C47 C52 . 1.387(8) ?
    C47 C48 . 1.401(8) ?
    C48 C49 . 1.387(8) ?
    C48 H48 . 0.9500 ?
    C49 C50 . 1.375(8) ?
    C49 H49 . 0.9500 ?
    C50 C51 . 1.399(8) ?
    C50 C53 . 1.440(8) ?
    C51 C52 . 1.389(8) ?
    C51 H51 . 0.9500 ?
    C52 H52 . 0.9500 ?
    C53 N54 . 1.138(8) ?
    O55 C56 . 1.463(7) ?
    O55 H55 . 1.0008 ?
    C56 H56A . 0.9800 ?
    C56 H56B . 0.9800 ?
    C56 H56C . 0.9800 ?
loop_
    _geom_angle_atom_site_label_1
    _geom_angle_atom_site_label_2
    _geom_angle_atom_site_label_3
    _geom_angle_site_symmetry_1
    _geom_angle_site_symmetry_3
    _geom_angle
    _geom_angle_publ_flag
    N21 Zn N22 . . 89.86(17) yes
    N21 Zn N23 . . 171.0(2) yes
    N21 Zn N24 . . 89.09(17) yes
    N22 Zn N23 . . 89.61(17) yes
    N22 Zn N24 . . 171.0(2) yes
    N23 Zn N24 . . 90.02(17) yes
    N21 Zn O55 . . 95.96(16) yes
    N22 Zn O55 . . 95.93(16) yes
    N23 Zn O55 . . 93.07(17) yes
    N24 Zn O55 . . 93.07(16) yes
    N21 C1 C20 . . 125.5(5) ?
    N21 C1 C2 . . 109.7(4) ?
    C20 C1 C2 . . 124.8(5) ?
    C3 C2 C1 . . 106.2(5) ?
    C3 C2 H2 . . 126.9 ?
    C1 C2 H2 . . 126.9 ?
    C2 C3 C4 . . 107.9(5) ?
    C2 C3 H3 . . 126.0 ?
    C4 C3 H3 . . 126.0 ?
    N21 C4 C5 . . 125.1(6) ?
    N21 C4 C3 . . 109.4(5) ?
    C5 C4 C3 . . 125.4(6) ?
    C4 C5 C6 . . 126.3(5) ?
    C4 C5 C25 . . 117.0(5) ?
    C6 C5 C25 . . 116.7(4) ?
    N22 C6 C5 . . 125.6(5) ?
    N22 C6 C7 . . 111.2(5) ?
    C5 C6 C7 . . 123.2(5) ?
    C8 C7 C6 . . 104.6(5) ?
    C8 C7 H7 . . 127.7 ?
    C6 C7 H7 . . 127.7 ?
    C7 C8 C9 . . 108.0(5) ?
    C7 C8 H8 . . 126.0 ?
    C9 C8 H8 . . 126.0 ?
    N22 C9 C8 . . 110.5(5) ?
    N22 C9 C10 . . 124.1(5) ?
    C8 C9 C10 . . 125.4(5) ?
    C11 C10 C9 . . 126.4(5) ?
    C11 C10 C31 . . 117.6(5) ?
    C9 C10 C31 . . 116.0(5) ?
    N23 C11 C10 . . 125.3(5) ?
    N23 C11 C12 . . 109.0(5) ?
    C10 C11 C12 . . 125.7(5) ?
    C13 C12 C11 . . 107.2(5) ?
    C13 C12 H12 . . 126.4 ?
    C11 C12 H12 . . 126.4 ?
    C12 C13 C14 . . 107.5(6) ?
    C12 C13 H13 . . 126.2 ?
    C14 C13 H13 . . 126.2 ?
    N23 C14 C15 . . 126.1(6) ?
    N23 C14 C13 . . 108.8(5) ?
    C15 C14 C13 . . 125.1(6) ?
    C14 C15 C16 . . 126.1(6) ?
    C14 C15 C39 . . 117.1(5) ?
    C16 C15 C39 . . 116.7(5) ?
    N24 C16 C15 . . 125.2(5) ?
    N24 C16 C17 . . 109.1(4) ?
    C15 C16 C17 . . 125.7(5) ?
    C18 C17 C16 . . 109.4(5) ?
    C18 C17 H17 . . 125.3 ?
    C16 C17 H17 . . 125.3 ?
    C17 C18 C19 . . 105.8(5) ?
    C17 C18 H18 . . 127.1 ?
    C19 C18 H18 . . 127.1 ?
    N24 C19 C20 . . 126.2(5) ?
    N24 C19 C18 . . 109.4(5) ?
    C20 C19 C18 . . 124.2(5) ?
    C19 C20 C1 . . 124.5(5) ?
    C19 C20 C47 . . 118.3(5) ?
    C1 C20 C47 . . 117.2(5) ?
    C1 N21 C4 . . 106.8(5) ?
    C1 N21 Zn . . 127.1(4) ?
    C4 N21 Zn . . 126.1(3) ?
    C6 N22 C9 . . 105.6(4) ?
    C6 N22 Zn . . 126.9(3) ?
    C9 N22 Zn . . 127.3(4) ?
    C11 N23 C14 . . 107.5(5) ?
    C11 N23 Zn . . 126.8(4) ?
    C14 N23 Zn . . 125.4(4) ?
    C19 N24 C16 . . 106.3(4) ?
    C19 N24 Zn . . 127.1(4) ?
    C16 N24 Zn . . 126.0(3) ?
    C30 C25 C26 . . 118.7(5) ?
    C30 C25 C5 . . 121.0(5) ?
    C26 C25 C5 . . 120.3(5) ?
    C25 C26 C27 . . 118.7(6) ?
    C25 C26 H26 . . 120.7 ?
    C27 C26 H26 . . 120.7 ?
    N28 C27 C26 . . 123.5(6) ?
    N28 C27 H27 . . 118.3 ?
    C26 C27 H27 . . 118.3 ?
    C27 N28 C29 . . 117.4(5) ?
    N28 C29 C30 . . 121.8(5) ?
    N28 C29 H29 . . 119.1 ?
    C30 C29 H29 . . 119.1 ?
    C25 C30 C29 . . 120.0(6) ?
    C25 C30 H30 . . 120.0 ?
    C29 C30 H30 . . 120.0 ?
    C36 C31 C32 . . 119.8(5) ?
    C36 C31 C10 . . 119.9(5) ?
    C32 C31 C10 . . 120.2(5) ?
    C31 C32 C33 . . 119.8(5) ?
    C31 C32 H32 . . 120.1 ?
    C33 C32 H32 . . 120.1 ?
    C34 C33 C32 . . 119.5(5) ?
    C34 C33 H33 . . 120.2 ?
    C32 C33 H33 . . 120.2 ?
    C35 C34 C33 . . 120.2(5) ?
    C35 C34 C37 . . 121.4(6) ?
    C33 C34 C37 . . 118.2(5) ?
    C34 C35 C36 . . 120.6(6) ?
    C34 C35 H35 . . 119.7 ?
    C36 C35 H35 . . 119.7 ?
    C31 C36 C35 . . 120.0(5) ?
    C31 C36 H36 . . 120.0 ?
    C35 C36 H36 . . 120.0 ?
    N38 C37 C34 . . 177.3(7) ?
    C44 C39 C40 . . 118.1(5) ?
    C44 C39 C15 . . 121.5(5) ?
    C40 C39 C15 . . 120.4(5) ?
    C41 C40 C39 . . 120.0(5) ?
    C41 C40 H40 . . 120.0 ?
    C39 C40 H40 . . 120.0 ?
    C42 C41 C40 . . 119.9(6) ?
    C42 C41 H41 . . 120.0 ?
    C40 C41 H41 . . 120.0 ?
    C43 C42 C41 . . 120.7(6) ?
    C43 C42 C45 . . 118.9(6) ?
    C41 C42 C45 . . 120.4(6) ?
    C42 C43 C44 . . 119.9(6) ?
    C42 C43 H43 . . 120.0 ?
    C44 C43 H43 . . 120.0 ?
    C43 C44 C39 . . 121.3(6) ?
    C43 C44 H44 . . 119.4 ?
    C39 C44 H44 . . 119.3 ?
    N46 C45 C42 . . 178.8(7) ?
    C52 C47 C48 . . 118.6(5) ?
    C52 C47 C20 . . 119.5(5) ?
    C48 C47 C20 . . 121.9(5) ?
    C49 C48 C47 . . 120.7(5) ?
    C49 C48 H48 . . 119.6 ?
    C47 C48 H48 . . 119.6 ?
    C50 C49 C48 . . 119.7(5) ?
    C50 C49 H49 . . 120.1 ?
    C48 C49 H49 . . 120.1 ?
    C49 C50 C51 . . 120.6(5) ?
    C49 C50 C53 . . 120.4(5) ?
    C51 C50 C53 . . 119.0(5) ?
    C52 C51 C50 . . 119.1(5) ?
    C52 C51 H51 . . 120.5 ?
    C50 C51 H51 . . 120.5 ?
    C47 C52 C51 . . 121.1(5) ?
    C47 C52 H52 . . 119.4 ?
    C51 C52 H52 . . 119.4 ?
    N54 C53 C50 . . 176.3(7) ?
    C56 O55 Zn . . 120.3(3) ?
    C56 O55 H55 . . 106.0 ?
    Zn O55 H55 . . 119.4 ?
    O55 C56 H56A . . 109.5 ?
    O55 C56 H56B . . 109.5 ?
    H56A C56 H56B . . 109.5 ?
    O55 C56 H56C . . 109.5 ?
    H56A C56 H56C . . 109.5 ?
    H56B C56 H56C . . 109.5 ?
loop_
    _geom_hbond_atom_site_label_D
    _geom_hbond_atom_site_label_H
    _geom_hbond_atom_site_label_A
    _geom_hbond_site_symmetry_A
    _geom_hbond_distance_DH
    _geom_hbond_distance_HA
    _geom_hbond_distance_DA
    _geom_hbond_angle_DHA
    O55 H55 N28 2_454 1.00 1.75 2.751(6) 175
data_global
_journal_date_recd_electronic     2006-08-24
_journal_date_accepted     2006-08-30
_journal_name_full     'Acta Crystallographica, Section C'
_journal_year     2006
_journal_volume     62
_journal_issue     10
_journal_page_first     m477
_journal_page_last     m479
_journal_paper_category     FM
_journal_coeditor_code     GD3047
_publ_contact_author_name     'Professor Israel Goldberg'
_publ_contact_author_address
;
School of Chemistry
Tel-Aviv University
Ramat-Aviv
69978 Tel-Aviv
Israel
;
_publ_contact_author_email     goldberg@post.tau.ac.il
_publ_contact_author_fax     '972 3 6409293'
_publ_contact_author_phone     '972 3 6409965'
_publ_section_title
;
Supramolecular assembly of
(methanol)[10,15,20-tris(4-cyanophenyl)-5-(4-pyridyl)porphyrinato]zinc(II) by
intermolecular hydrogen bonding and weak coordination
;
loop_
    _publ_author_name
    _publ_author_address
    'Sankar Muniappan'
;
School of Chemistry
Sackler Faculty of Exact Sciences
Tel-Aviv University
Ramat-Aviv
69978 Tel-Aviv
Israel
;
    'Sophia Lipstman'
;
School of Chemistry
Sackler Faculty of Exact Sciences
Tel-Aviv University
Ramat-Aviv
69978 Tel-Aviv
Israel
;
    'Israel Goldberg'
;
School of Chemistry
Sackler Faculty of Exact Sciences
Tel-Aviv University
Ramat-Aviv
69978 Tel-Aviv
Israel
;
