##############################################################################
###                                                                        ###
###        Electronic paper (Acta Crystallographica Section E)             ###
###                                                                        ###
##############################################################################
#                                                                            #
# This CIF contains the data in a paper accepted for publication in Acta     #
# Crystallographica Section E. It conforms to the requirements of Notes      #
# for Authors for Section E, 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/  #
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#                                                                            #
#            Copyright International Union of Crystallography                #
#                                                                            #
##############################################################################
                                             
data_I
_audit_creation_method     SHELXL-97
_chemical_name_systematic
;
trans-Dichlorobis(tris{4-[(dimethylamino)methyl]phenyl}phosphine)platinum(II)
;
_chemical_name_common     ?
_chemical_formula_moiety     'C54 H72 Cl2 N6 P2 Pt'
_chemical_formula_sum     'C54 H72 Cl2 N6 P2 Pt'
_chemical_formula_iupac     '[Pt Cl2 (C27 H36 N3 P1)2]'
_chemical_formula_weight     1133.11
_chemical_melting_point     ?
_symmetry_cell_setting     monoclinic
_symmetry_space_group_name_H-M     'P 21/c'
_symmetry_space_group_name_Hall     '-P 2ybc'
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'
_cell_length_a     13.11220(10)
_cell_length_b     17.62000(10)
_cell_length_c     11.61800(10)
_cell_angle_alpha     90.00
_cell_angle_beta     94.9554(4)
_cell_angle_gamma     90.00
_cell_volume     2674.16(3)
_cell_formula_units_Z     2
_cell_measurement_reflns_used     43969
_cell_measurement_theta_min     1.02
_cell_measurement_theta_max     27.48
_cell_measurement_temperature     150(2)
_exptl_crystal_description     block
_exptl_crystal_colour     yellowish
_exptl_crystal_size_max     0.27
_exptl_crystal_size_mid     0.09
_exptl_crystal_size_min     0.09
_exptl_crystal_density_diffrn     1.407
_exptl_crystal_density_meas     ?
_exptl_crystal_density_method     'not measured'
_exptl_crystal_F_000     1160
_exptl_absorpt_coefficient_mu     2.824
_exptl_absorpt_correction_type     multi-scan
_exptl_absorpt_process_details     '(SADABS; Sheldrick, 2002)'
_exptl_absorpt_correction_T_min     0.62
_exptl_absorpt_correction_T_max     0.78
_exptl_special_details
;
The X-ray intensities were obtained with two different exposure times and
rotation angles of 1°. 363 φ and 334 ω scans were measured with an exposure
time of 40 s per frame; 206 φ and 90 ω scans with an exposure time of 8 s
per frame. The frames were integrated with DENZO (Otwinowski & Minor,
1997) and the resulting files were converted with DENZOX
(Farrugia,
2004). The resulting file was scaled and corrected for absorption with
SADABS (Sheldrick, 2002).
;
_diffrn_ambient_temperature     150(2)
_diffrn_radiation_type     MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_source     'rotating anode'
_diffrn_radiation_monochromator     graphite
_diffrn_measurement_device_type     'Nonius KappaCCD'
_diffrn_measurement_method     'φ and ω'
_diffrn_detector_area_resol_mean     ?
_diffrn_reflns_number     57383
_diffrn_reflns_av_R_equivalents     0.0381
_diffrn_reflns_av_sigmaI/netI     0.0217
_diffrn_reflns_theta_min     1.94
_diffrn_reflns_theta_max     27.50
_diffrn_reflns_theta_full     27.50
_diffrn_measured_fraction_theta_max     0.999
_diffrn_measured_fraction_theta_full     0.999
_diffrn_reflns_limit_h_min     -17
_diffrn_reflns_limit_h_max     17
_diffrn_reflns_limit_k_min     -22
_diffrn_reflns_limit_k_max     22
_diffrn_reflns_limit_l_min     -15
_diffrn_reflns_limit_l_max     15
_diffrn_standards_number     ?
_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     6131
_reflns_number_gt     5028
_reflns_threshold_expression     I>2σ(I)
_refine_ls_structure_factor_coef     Fsqd
_refine_ls_matrix_type     full
_refine_ls_R_factor_all     0.0292
_refine_ls_R_factor_gt     0.0203
_refine_ls_wR_factor_gt     0.0469
_refine_ls_wR_factor_ref     0.0500
_refine_ls_goodness_of_fit_ref     1.037
_refine_ls_restrained_S_all     1.037
_refine_ls_number_reflns     6131
_refine_ls_number_parameters     301
_refine_ls_number_restraints     0
_refine_ls_hydrogen_treatment     constr
_refine_ls_weighting_scheme     calc
_refine_ls_weighting_details
         'calc w=1/[σ²(Fo²)+(0.0197P)²+2.3473P] 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     0.001
_refine_ls_shift/su_mean     0.000
_refine_diff_density_max     0.843
_refine_diff_density_min     -0.496
_refine_ls_extinction_method     none
_refine_ls_extinction_coef     ?
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'
    'Cl' 'Cl' 0.1484 0.1585
                         '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'
    'P' 'P' 0.1023 0.0942
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
    'Pt' 'Pt' -1.7033 8.3905
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
_computing_data_collection     'COLLECT (Nonius, 1999)'
_computing_cell_refinement     'HKL2000 (Otwinowski & Minor, 1997)'
_computing_data_reduction
;
HKL2000, DENZOX (Farrugia, 2004) and SADABS (Sheldrick, 2002)
;
_computing_structure_solution     'SHELXS97 (Sheldrick, 1997)'
_computing_structure_refinement     'SHELXL97 (Sheldrick, 1997)'
_computing_molecular_graphics     'PLATON (Spek, 2003)'
_computing_publication_material     'manually editing SHELXL97 output'
loop_
    _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
    _atom_site_type_symbol
    Pt1 0.5000 0.5000 0.5000 0.01778(4) Uani d S 1 . . Pt
    Cl1 0.67425(4) 0.51413(3) 0.53872(5) 0.02918(13) Uani d . 1 . . Cl
    P1 0.50904(4) 0.51907(3) 0.30349(5) 0.01878(11) Uani d . 1 . . P
    N1 0.20169(17) 0.23248(12) 0.0739(2) 0.0389(5) Uani d . 1 . . N
    N2 0.21225(15) 0.77656(11) 0.01699(18) 0.0321(5) Uani d . 1 . . N
    N3 1.02199(15) 0.52548(13) 0.23664(18) 0.0321(5) Uani d . 1 . . N
    C11 0.43711(16) 0.44688(12) 0.21934(18) 0.0205(4) Uani d . 1 . . C
    C12 0.37972(17) 0.46236(13) 0.11618(19) 0.0236(5) Uani d . 1 . . C
    H12 0.3735 0.5131 0.0889 0.028 Uiso calc R 1 . . H
    C13 0.33130(17) 0.40397(13) 0.05250(19) 0.0264(5) Uani d . 1 . . C
    H13 0.2917 0.4156 -0.0177 0.032 Uiso calc R 1 . . H
    C14 0.33928(17) 0.32905(13) 0.0888(2) 0.0270(5) Uani d . 1 . . C
    C15 0.39626(19) 0.31364(13) 0.1932(2) 0.0317(5) Uani d . 1 . . C
    H15 0.4028 0.2628 0.2202 0.038 Uiso calc R 1 . . H
    C16 0.44340(18) 0.37193(13) 0.2578(2) 0.0291(5) Uani d . 1 . . C
    H16 0.4807 0.3606 0.3295 0.035 Uiso calc R 1 . . H
    C17 0.2852(2) 0.26743(14) 0.0170(2) 0.0362(6) Uani d . 1 . . C
    H17A 0.2573 0.2892 -0.0577 0.043 Uiso calc R 1 . . H
    H17B 0.3354 0.2278 0.0006 0.043 Uiso calc R 1 . . H
    C18 0.1293(2) 0.28785(18) 0.1088(3) 0.0569(9) Uani d . 1 . . C
    H18A 0.1019 0.3169 0.0411 0.085 Uiso calc R 1 . . H
    H18B 0.1638 0.3224 0.1657 0.085 Uiso calc R 1 . . H
    H18C 0.0732 0.2619 0.1430 0.085 Uiso calc R 1 . . H
    C19 0.1498(2) 0.17720(16) -0.0053(3) 0.0503(8) Uani d . 1 . . C
    H19A 0.0945 0.1527 0.0325 0.075 Uiso calc R 1 . . H
    H19B 0.1991 0.1387 -0.0259 0.075 Uiso calc R 1 . . H
    H19C 0.1213 0.2032 -0.0753 0.075 Uiso calc R 1 . . H
    C21 0.45621(16) 0.61024(12) 0.25173(18) 0.0199(4) Uani d . 1 . . C
    C22 0.46979(17) 0.63671(12) 0.14063(19) 0.0233(5) Uani d . 1 . . C
    H22 0.5155 0.6112 0.0947 0.028 Uiso calc R 1 . . H
    C23 0.41679(17) 0.70013(12) 0.09704(19) 0.0245(5) Uani d . 1 . . C
    H23 0.4265 0.7176 0.0214 0.029 Uiso calc R 1 . . H
    C24 0.34945(17) 0.73839(12) 0.16345(19) 0.0238(5) Uani d . 1 . . C
    C25 0.34154(18) 0.71457(12) 0.27606(19) 0.0263(5) Uani d . 1 . . C
    H25 0.3000 0.7424 0.3242 0.032 Uiso calc R 1 . . H
    C26 0.39363(17) 0.65051(13) 0.31955(19) 0.0252(5) Uani d . 1 . . C
    H26 0.3861 0.6344 0.3964 0.030 Uiso calc R 1 . . H
    C27 0.28317(18) 0.80230(12) 0.1129(2) 0.0273(5) Uani d . 1 . . C
    H27A 0.2438 0.8241 0.1739 0.033 Uiso calc R 1 . . H
    H27B 0.3274 0.8428 0.0854 0.033 Uiso calc R 1 . . H
    C28 0.1540(2) 0.84024(16) -0.0341(2) 0.0413(6) Uani d . 1 . . C
    H28A 0.1101 0.8227 -0.1014 0.062 Uiso calc R 1 . . H
    H28B 0.2011 0.8791 -0.0584 0.062 Uiso calc R 1 . . H
    H28C 0.1114 0.8619 0.0230 0.062 Uiso calc R 1 . . H
    C29 0.1430(2) 0.71944(16) 0.0549(3) 0.0542(8) Uani d . 1 . . C
    H29A 0.1038 0.7407 0.1154 0.081 Uiso calc R 1 . . H
    H29B 0.1825 0.6756 0.0858 0.081 Uiso calc R 1 . . H
    H29C 0.0960 0.7033 -0.0106 0.081 Uiso calc R 1 . . H
    C31 0.63528(16) 0.51560(12) 0.24951(18) 0.0210(4) Uani d . 1 . . C
    C32 0.70435(17) 0.57466(13) 0.27647(19) 0.0240(5) Uani d . 1 . . C
    H32 0.6835 0.6176 0.3179 0.029 Uiso calc R 1 . . H
    C33 0.80304(17) 0.57073(13) 0.24299(19) 0.0262(5) Uani d . 1 . . C
    H33 0.8491 0.6115 0.2610 0.031 Uiso calc R 1 . . H
    C34 0.83605(17) 0.50777(13) 0.18317(19) 0.0258(5) Uani d . 1 . . C
    C35 0.76676(18) 0.45011(13) 0.1554(2) 0.0276(5) Uani d . 1 . . C
    H35 0.7876 0.4073 0.1137 0.033 Uiso calc R 1 . . H
    C36 0.66731(17) 0.45368(13) 0.18719(19) 0.0251(5) Uani d . 1 . . C
    H36 0.6207 0.4137 0.1664 0.030 Uiso calc R 1 . . H
    C37 0.94398(18) 0.50366(14) 0.1470(2) 0.0303(5) Uani d . 1 . . C
    H37A 0.9576 0.4511 0.1226 0.036 Uiso calc R 1 . . H
    H37B 0.9491 0.5371 0.0793 0.036 Uiso calc R 1 . . H
    C38 1.1225(2) 0.52303(17) 0.1910(3) 0.0423(7) Uani d . 1 . . C
    H38A 1.1749 0.5401 0.2506 0.063 Uiso calc R 1 . . H
    H38B 1.1224 0.5564 0.1235 0.063 Uiso calc R 1 . . H
    H38C 1.1375 0.4709 0.1683 0.063 Uiso calc R 1 . . H
    C39 1.0225(2) 0.47619(19) 0.3361(2) 0.0462(7) Uani d . 1 . . C
    H39A 1.0342 0.4237 0.3125 0.069 Uiso calc R 1 . . H
    H39B 0.9564 0.4797 0.3692 0.069 Uiso calc R 1 . . H
    H39C 1.0773 0.4918 0.3940 0.069 Uiso calc R 1 . . H
_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
    Pt1 Cl1 . 2.3038(5) yes
    Pt1 Cl1 3_666 2.3038(5) ?
    Pt1 P1 3_666 2.3207(5) ?
    Pt1 P1 . 2.3208(5) yes
    P1 C11 . 1.818(2) yes
    P1 C21 . 1.830(2) yes
    P1 C31 . 1.821(2) yes
    N1 C18 . 1.443(4) ?
    N1 C17 . 1.463(3) ?
    N1 C19 . 1.466(3) ?
    N2 C29 . 1.449(4) ?
    N2 C28 . 1.455(3) ?
    N2 C27 . 1.461(3) ?
    N3 C39 . 1.445(3) ?
    N3 C37 . 1.447(3) ?
    N3 C38 . 1.463(3) ?
    C11 C12 . 1.386(3) ?
    C11 C16 . 1.394(3) ?
    C12 C13 . 1.388(3) ?
    C12 H12 . 0.9500 ?
    C13 C14 . 1.387(3) ?
    C13 H13 . 0.9500 ?
    C14 C15 . 1.395(3) ?
    C14 C17 . 1.509(3) ?
    C15 C16 . 1.385(3) ?
    C15 H15 . 0.9500 ?
    C16 H16 . 0.9500 ?
    C17 H17A . 0.9900 ?
    C17 H17B . 0.9900 ?
    C18 H18A . 0.9800 ?
    C18 H18B . 0.9800 ?
    C18 H18C . 0.9800 ?
    C19 H19A . 0.9800 ?
    C19 H19B . 0.9800 ?
    C19 H19C . 0.9800 ?
    C21 C26 . 1.382(3) ?
    C21 C22 . 1.398(3) ?
    C22 C23 . 1.388(3) ?
    C22 H22 . 0.9500 ?
    C23 C24 . 1.396(3) ?
    C23 H23 . 0.9500 ?
    C24 C25 . 1.386(3) ?
    C24 C27 . 1.510(3) ?
    C25 C26 . 1.391(3) ?
    C25 H25 . 0.9500 ?
    C26 H26 . 0.9500 ?
    C27 H27A . 0.9900 ?
    C27 H27B . 0.9900 ?
    C28 H28A . 0.9800 ?
    C28 H28B . 0.9800 ?
    C28 H28C . 0.9800 ?
    C29 H29A . 0.9800 ?
    C29 H29B . 0.9800 ?
    C29 H29C . 0.9800 ?
    C31 C36 . 1.394(3) ?
    C31 C32 . 1.397(3) ?
    C32 C33 . 1.385(3) ?
    C32 H32 . 0.9500 ?
    C33 C34 . 1.398(3) ?
    C33 H33 . 0.9500 ?
    C34 C35 . 1.382(3) ?
    C34 C37 . 1.512(3) ?
    C35 C36 . 1.387(3) ?
    C35 H35 . 0.9500 ?
    C36 H36 . 0.9500 ?
    C37 H37A . 0.9900 ?
    C37 H37B . 0.9900 ?
    C38 H38A . 0.9800 ?
    C38 H38B . 0.9800 ?
    C38 H38C . 0.9800 ?
    C39 H39A . 0.9800 ?
    C39 H39B . 0.9800 ?
    C39 H39C . 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
    Cl1 Pt1 Cl1 . 3_666 180.0 ?
    Cl1 Pt1 P1 . 3_666 87.573(19) yes
    Cl1 Pt1 P1 3_666 3_666 92.429(19) ?
    Cl1 Pt1 P1 . . 92.430(19) yes
    Cl1 Pt1 P1 3_666 . 87.569(19) ?
    P1 Pt1 P1 3_666 . 180.0 ?
    C11 P1 C31 . . 103.66(10) ?
    C11 P1 C21 . . 105.87(9) ?
    C31 P1 C21 . . 104.23(10) ?
    C11 P1 Pt1 . . 111.07(7) ?
    C31 P1 Pt1 . . 117.33(7) ?
    C21 P1 Pt1 . . 113.60(7) ?
    C18 N1 C17 . . 112.2(2) ?
    C18 N1 C19 . . 110.2(2) ?
    C17 N1 C19 . . 108.7(2) ?
    C29 N2 C28 . . 109.8(2) ?
    C29 N2 C27 . . 111.0(2) ?
    C28 N2 C27 . . 110.5(2) ?
    C39 N3 C37 . . 111.7(2) ?
    C39 N3 C38 . . 109.2(2) ?
    C37 N3 C38 . . 109.5(2) ?
    C12 C11 C16 . . 118.4(2) ?
    C12 C11 P1 . . 123.03(16) ?
    C16 C11 P1 . . 118.48(16) ?
    C11 C12 C13 . . 120.3(2) ?
    C11 C12 H12 . . 119.9 ?
    C13 C12 H12 . . 119.9 ?
    C14 C13 C12 . . 121.6(2) ?
    C14 C13 H13 . . 119.2 ?
    C12 C13 H13 . . 119.2 ?
    C13 C14 C15 . . 118.1(2) ?
    C13 C14 C17 . . 119.8(2) ?
    C15 C14 C17 . . 122.1(2) ?
    C16 C15 C14 . . 120.5(2) ?
    C16 C15 H15 . . 119.8 ?
    C14 C15 H15 . . 119.8 ?
    C15 C16 C11 . . 121.2(2) ?
    C15 C16 H16 . . 119.4 ?
    C11 C16 H16 . . 119.4 ?
    N1 C17 C14 . . 112.8(2) ?
    N1 C17 H17A . . 109.0 ?
    C14 C17 H17A . . 109.0 ?
    N1 C17 H17B . . 109.0 ?
    C14 C17 H17B . . 109.0 ?
    H17A C17 H17B . . 107.8 ?
    N1 C18 H18A . . 109.5 ?
    N1 C18 H18B . . 109.5 ?
    H18A C18 H18B . . 109.5 ?
    N1 C18 H18C . . 109.5 ?
    H18A C18 H18C . . 109.5 ?
    H18B C18 H18C . . 109.5 ?
    N1 C19 H19A . . 109.5 ?
    N1 C19 H19B . . 109.5 ?
    H19A C19 H19B . . 109.5 ?
    N1 C19 H19C . . 109.5 ?
    H19A C19 H19C . . 109.5 ?
    H19B C19 H19C . . 109.5 ?
    C26 C21 C22 . . 118.96(19) ?
    C26 C21 P1 . . 119.33(16) ?
    C22 C21 P1 . . 121.43(16) ?
    C23 C22 C21 . . 120.4(2) ?
    C23 C22 H22 . . 119.8 ?
    C21 C22 H22 . . 119.8 ?
    C22 C23 C24 . . 120.5(2) ?
    C22 C23 H23 . . 119.7 ?
    C24 C23 H23 . . 119.7 ?
    C25 C24 C23 . . 118.5(2) ?
    C25 C24 C27 . . 120.4(2) ?
    C23 C24 C27 . . 121.0(2) ?
    C24 C25 C26 . . 120.9(2) ?
    C24 C25 H25 . . 119.5 ?
    C26 C25 H25 . . 119.5 ?
    C21 C26 C25 . . 120.4(2) ?
    C21 C26 H26 . . 119.8 ?
    C25 C26 H26 . . 119.8 ?
    N2 C27 C24 . . 111.86(18) ?
    N2 C27 H27A . . 109.2 ?
    C24 C27 H27A . . 109.2 ?
    N2 C27 H27B . . 109.2 ?
    C24 C27 H27B . . 109.2 ?
    H27A C27 H27B . . 107.9 ?
    N2 C28 H28A . . 109.5 ?
    N2 C28 H28B . . 109.5 ?
    H28A C28 H28B . . 109.5 ?
    N2 C28 H28C . . 109.5 ?
    H28A C28 H28C . . 109.5 ?
    H28B C28 H28C . . 109.5 ?
    N2 C29 H29A . . 109.5 ?
    N2 C29 H29B . . 109.5 ?
    H29A C29 H29B . . 109.5 ?
    N2 C29 H29C . . 109.5 ?
    H29A C29 H29C . . 109.5 ?
    H29B C29 H29C . . 109.5 ?
    C36 C31 C32 . . 118.7(2) ?
    C36 C31 P1 . . 121.92(17) ?
    C32 C31 P1 . . 119.25(16) ?
    C33 C32 C31 . . 120.2(2) ?
    C33 C32 H32 . . 119.9 ?
    C31 C32 H32 . . 119.9 ?
    C32 C33 C34 . . 121.1(2) ?
    C32 C33 H33 . . 119.5 ?
    C34 C33 H33 . . 119.5 ?
    C35 C34 C33 . . 118.3(2) ?
    C35 C34 C37 . . 120.8(2) ?
    C33 C34 C37 . . 120.9(2) ?
    C34 C35 C36 . . 121.2(2) ?
    C34 C35 H35 . . 119.4 ?
    C36 C35 H35 . . 119.4 ?
    C35 C36 C31 . . 120.4(2) ?
    C35 C36 H36 . . 119.8 ?
    C31 C36 H36 . . 119.8 ?
    N3 C37 C34 . . 114.08(19) ?
    N3 C37 H37A . . 108.7 ?
    C34 C37 H37A . . 108.7 ?
    N3 C37 H37B . . 108.7 ?
    C34 C37 H37B . . 108.7 ?
    H37A C37 H37B . . 107.6 ?
    N3 C38 H38A . . 109.5 ?
    N3 C38 H38B . . 109.5 ?
    H38A C38 H38B . . 109.5 ?
    N3 C38 H38C . . 109.5 ?
    H38A C38 H38C . . 109.5 ?
    H38B C38 H38C . . 109.5 ?
    N3 C39 H39A . . 109.5 ?
    N3 C39 H39B . . 109.5 ?
    H39A C39 H39B . . 109.5 ?
    N3 C39 H39C . . 109.5 ?
    H39A C39 H39C . . 109.5 ?
    H39B C39 H39C . . 109.5 ?
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_site_symmetry_1
    _geom_torsion_site_symmetry_2
    _geom_torsion_site_symmetry_3
    _geom_torsion_site_symmetry_4
    _geom_torsion
    _geom_torsion_publ_flag
    Pt1 P1 C11 C16 . . . . -41.2(2) yes
    Pt1 P1 C21 C26 . . . . -16.5(2) yes
    Pt1 P1 C31 C32 . . . . -71.20(18) yes
    C19 N1 C17 C14 . . . . 176.3(2) yes
    C28 N2 C27 C24 . . . . -176.6(2) yes
    C38 N3 C37 C34 . . . . -177.3(2) yes
    C15 C14 C17 N1 . . . . 66.2(3) yes
    C23 C24 C27 N2 . . . . 62.1(3) yes
    C33 C34 C37 N3 . . . . 45.6(3) yes
    Cl1 Pt1 P1 C11 . . . . 132.12(8) ?
    Cl1 Pt1 P1 C11 3_666 . . . -47.89(8) ?
    Cl1 Pt1 P1 C31 . . . . 13.17(8) ?
    Cl1 Pt1 P1 C31 3_666 . . . -166.83(8) ?
    Cl1 Pt1 P1 C21 . . . . -108.67(8) ?
    Cl1 Pt1 P1 C21 3_666 . . . 71.32(8) ?
    C31 P1 C11 C12 . . . . -91.54(19) ?
    C21 P1 C11 C12 . . . . 17.9(2) ?
    Pt1 P1 C11 C12 . . . . 141.60(17) ?
    C31 P1 C11 C16 . . . . 85.7(2) ?
    C21 P1 C11 C16 . . . . -164.94(18) ?
    C16 C11 C12 C13 . . . . -1.0(3) ?
    P1 C11 C12 C13 . . . . 176.22(17) ?
    C11 C12 C13 C14 . . . . -0.6(4) ?
    C12 C13 C14 C15 . . . . 1.2(4) ?
    C12 C13 C14 C17 . . . . 179.9(2) ?
    C13 C14 C15 C16 . . . . -0.2(4) ?
    C17 C14 C15 C16 . . . . -178.9(2) ?
    C14 C15 C16 C11 . . . . -1.4(4) ?
    C12 C11 C16 C15 . . . . 2.0(4) ?
    P1 C11 C16 C15 . . . . -175.38(19) ?
    C18 N1 C17 C14 . . . . 54.2(3) ?
    C13 C14 C17 N1 . . . . -112.5(3) ?
    C11 P1 C21 C26 . . . . 105.64(18) ?
    C31 P1 C21 C26 . . . . -145.38(18) ?
    C11 P1 C21 C22 . . . . -68.3(2) ?
    C31 P1 C21 C22 . . . . 40.7(2) ?
    Pt1 P1 C21 C22 . . . . 169.60(15) ?
    C26 C21 C22 C23 . . . . -3.5(3) ?
    P1 C21 C22 C23 . . . . 170.45(17) ?
    C21 C22 C23 C24 . . . . 0.1(3) ?
    C22 C23 C24 C25 . . . . 3.9(3) ?
    C22 C23 C24 C27 . . . . -173.6(2) ?
    C23 C24 C25 C26 . . . . -4.7(3) ?
    C27 C24 C25 C26 . . . . 172.8(2) ?
    C22 C21 C26 C25 . . . . 2.7(3) ?
    P1 C21 C26 C25 . . . . -171.32(17) ?
    C24 C25 C26 C21 . . . . 1.4(3) ?
    C29 N2 C27 C24 . . . . 61.4(3) ?
    C25 C24 C27 N2 . . . . -115.4(2) ?
    C11 P1 C31 C36 . . . . -17.6(2) ?
    C21 P1 C31 C36 . . . . -128.19(18) ?
    Pt1 P1 C31 C36 . . . . 105.23(17) ?
    C11 P1 C31 C32 . . . . 165.98(17) ?
    C21 P1 C31 C32 . . . . 55.37(19) ?
    C36 C31 C32 C33 . . . . -0.9(3) ?
    P1 C31 C32 C33 . . . . 175.63(17) ?
    C31 C32 C33 C34 . . . . -0.8(3) ?
    C32 C33 C34 C35 . . . . 1.7(3) ?
    C32 C33 C34 C37 . . . . -179.8(2) ?
    C33 C34 C35 C36 . . . . -1.0(3) ?
    C37 C34 C35 C36 . . . . -179.4(2) ?
    C34 C35 C36 C31 . . . . -0.7(3) ?
    C32 C31 C36 C35 . . . . 1.7(3) ?
    P1 C31 C36 C35 . . . . -174.80(17) ?
    C39 N3 C37 C34 . . . . 61.6(3) ?
    C35 C34 C37 N3 . . . . -136.0(2) ?
data_global
_journal_date_recd_electronic     2005-11-22
_journal_date_accepted     2005-11-23
_journal_name_full     'Acta Crystallographica, Section E'
_journal_year     2005
_journal_volume     61
_journal_issue     12
_journal_page_first     m2728
_journal_page_last     m2729
_journal_paper_category     EM
_journal_coeditor_code     BT6791
_publ_contact_author_name     'Martin Lutz'
_publ_contact_author_address
;
Bijvoet Center for Biomolecular Research
Department of Crystal and Structural Chemistry
Utrecht University
Padualaan 8
3584 CH Utrecht
The Netherlands
;
_publ_contact_author_email     m.lutz@chem.uu.nl
_publ_contact_author_fax     '[+31] 30 2533940'
_publ_contact_author_phone     '[+31] 30 2533902'
_publ_section_title
;\
trans-Dichlorobis(tris{4-[(dimethylamino)methyl]phenyl}phosphine)\
platinum(II)
;
loop_
    _publ_author_name
    _publ_author_address
    'Lutz, Martin'
;
Bijvoet Center for Biomolecular Research
Crystal and Structural Chemistry
Utrecht University
Padualaan 8
3584 CH Utrecht
The Netherlands
;
    'Spek, Anthony L.'
;
Bijvoet Center for Biomolecular Research
Crystal and Structural Chemistry
Utrecht University
Padualaan 8
3584 CH Utrecht
The Netherlands
;
    'Kreiter, Robert'
;
Debye Institute
Organic Chemistry and Catalysis
Utrecht University
Padualaan 8
3584 CH Utrecht
The Netherlands
;
    'Klein Gebbink, Robertus J. M.'
;
Debye Institute
Organic Chemistry and Catalysis
Utrecht University
Padualaan 8
3584 CH Utrecht
The Netherlands
;
    'Koten, Gerard van'
;
Debye Institute
Organic Chemistry and Catalysis
Utrecht University
Padualaan 8
3584 CH Utrecht
The Netherlands
;
