#------------------------------------------------------------------------------
#$Date: 2011-09-28 15:24:46 +0100 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: svn://www.crystallography.net/cod/cif/2/00/47/2004791.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_2004791
_journal_name_full               'Acta Crystallographica C'
_journal_volume                  52
_journal_year      1996
_journal_page_first     827
_journal_page_last     829
_publ_section_title
;
(Dimethyl sulfoxide-S)methyl(1,10-phenanthroline-N,N')platinum(II)
Hexafluorophosphate
;
_chemical_formula_iupac     '[Pt1 (C1 H3)(C2 H6 O1 S1)(C12 H8 N2)] P1 F6'
_chemical_formula_moiety     'C15 H17 N2 O Pt S , P F6'
_chemical_formula_sum     'C15 H17 F6 N2 O P Pt S'
_chemical_formula_weight     613.43
_symmetry_cell_setting    'triclinic'
loop_
_symmetry_equiv_pos_as_xyz
'x,y,z'
'-x,-y,-z'
_symmetry_space_group_name_H-M     'P -1'
_cell_length_a     7.5690(10)
_cell_length_b     11.557(2)
_cell_length_c     12.158(3)
_cell_angle_alpha     61.840(10)
_cell_angle_beta     88.74(2)
_cell_angle_gamma     84.590(10)
_cell_volume     933.2(3)
_cell_formula_units_Z     2
_exptl_crystal_density_diffrn     2.183
_exptl_crystal_density_meas     2.180
_cell_measurement_temperature     293
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Pt .19040(10)
            .27100(10)
                     .12680(10)
                              .0350(10)
N(1) .1528(5) .4263(4) .1756(4) .0410(10)
C(2) .0969(7) .4241(5) .2802(5) .0510(10)
C(3) .0895(9) .5356(7) .2991(6) .067(2)
C(4) .1431(8) .6501(6) .2087(6) .068(2)
C(5) .2617(7) .7737(6) -.0071(6) .061(2)
C(6) .3176(7) .7733(6)
                      -0.1126(6) .059(2)
C(7) .3753(7) .6537(6)
                      -0.2370(5) .0560(10)
C(8) .3759(7) .5392(6)
                      -0.2421(5) .057(2)
C(9) .3223(7) .4287(5)
                      -0.1409(5) .0480(10)
N(10) .2677(5) .4280(4) -.0358(3) .0380(10)
C(11) .2663(6) .5437(5) -.0295(4) .0380(10)
C(12) .3202(6) .6588(5)
                       -0.1273(5) .0480(10)
C(13) .2069(6) .5427(5) .0832(5) .0400(10)
C(14) .2045(7) .6580(5) .0953(5) .0510(10)
S .1108(2) .11300(10)
                    .30650(10)
                             .0400(10)
O -.0412(5) .1525(4) .3630(3) .0540(10)
C(15) .0656(8) -.0374(6) .3118(6) .061(2)
C(16) .2941(7) .0580(5) .4130(5) .0510(10)
C(17) .2448(9) .1388(6) .0593(5) .061(2)
P .6253(2)
          -0.2360(2) .3590(2) .0560(10)
F(1) .6194(6) -.0844(4) .3180(4) .103(2)
F(2) .7604(7)
             -0.2150(6) .2540(5) .129(2)
F(3) .4985(10)
              -0.2536(6) .4650(6) .177(3)
F(4) .6396(9)
             -0.3861(5) .4037(6) .144(2)
F(5) .7882(9)
             -0.2551(6) .4455(5) .153(2)
F(6) .4729(7)
             -0.2170(7) .2700(6) .165(3)
H(2) .0611(7) .3459(5) .3437(5) .080
H(3) .0478(9) .5306(7) .3736(6) .080
H(4) .1394(8) .7236(6) .2214(6) .080
H(5) .2603(7) .8508(6) -.0007(6) .080
H(6) .3554(7) .8499(6)
                      -0.1773(6) .080
H(7) .4108(7) .7286(6)
                      -0.3051(5) .080
H(8) .4124(7) .5350(6)
                      -0.3138(5) .080
H(9) .3243(7) .3510(5)
                      -0.1464(5) .080
H(15A) -.0334(8) -.0215(6) .2569(6) .080
H(15B) .0379(8) -.0990(6) .3955(6) .080
H(15C) .1680(8) -.0731(6) .2859(6) .080
H(16A) .3330(7) .1314(5) .4192(5) .080
H(16B) .3893(7) .0193(5) .3839(5) .080
H(16C) .2593(7) -.0066(5) .4935(5) .080
H(17A) .2183(9) .0528(6) .1214(5) .080
H(17B) .3682(9) .1361(6) .0396(5) .080
H(17C) .1735(9) .1657(6) -.0146(5) .080
_cod_database_code 2004791