data_2010733
_journal_name_full  'Acta Crystallographica, Section C'
_journal_year  2000
_journal_volume  56
_journal_page_first  299
_journal_page_last  300
_publ_section_title
;
Dichlorodiethylbis(pyridine)tin(IV)
;
loop_
_publ_author_name
  "Casas, Jos\'e S."
  "Garc\'ia-Mart\'inez, Emilia"
  "S\'anchez-Gonz\'alez, Angeles"
  "Sordo, Jos\'e"
  'Villar, Roberto'
_chemical_formula_moiety  'C14 H20 Cl2 N2 Sn'
_chemical_formula_sum  'C14 H20 Cl2 N2 Sn'
_chemical_formula_iupac  '[Sn Cl2 (C2 H5 )2 (C5 H5 N) 2]'
_chemical_formula_weight  405.91
_symmetry_cell_setting  monoclinic
_symmetry_space_group_name_H-M  'C 2/c'
loop_
_symmetry_equiv_pos_as_xyz
  'x, y, z'
  '-x, y, -z+1/2'
  'x+1/2, y+1/2, z'
  '-x+1/2, y+1/2, -z+1/2'
  '-x, -y, -z'
  'x, -y, z-1/2'
  '-x+1/2, -y+1/2, -z'
  'x+1/2, -y+1/2, z-1/2'
_cell_length_a  13.9828(3)
_cell_length_b  9.6029(2)
_cell_length_c  14.0432(2)
_cell_angle_alpha  90.00
_cell_angle_beta  113.7640(13)
_cell_angle_gamma  90.00
_cell_volume  1725.78(6)
_cell_formula_units_Z  4
_cell_measurement_temperature  293(2)
_exptl_crystal_density_diffrn  1.562
_diffrn_ambient_temperature  293(2)
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
  Sn  .0000  .0000  .0000  .04881(12) Uani d S 1 . . Sn
  Cl  -.06320(8)  .21590(11)  .06917(7)  .0718(3) Uani d . 1 . . Cl
  N  .1660(2)  .0080(3)  .1476(2)  .0597(7) Uani d . 1 . . N
  C1  .2500(3)  -.0542(4)  .1455(3)  .0677(9) Uani d . 1 . . C
  H1  .2449  -.0964  .0840  .081 Uiso calc R 1 . . H
  C2  .3437(3)  -.0590(4)  .2299(3)  .0790(11) Uani d . 1 . . C
  H2  .4010  -.1032  .2256  .095 Uiso calc R 1 . . H
  C3  .3517(3)  .0022(4)  .3207(4)  .0824(13) Uani d . 1 . . C
  H3  .4143  -.0003  .3794  .099 Uiso calc R 1 . . H
  C4  .2667(3)  .0666(5)  .3236(3)  .0830(12) Uani d . 1 . . C
  H4  .2705  .1095  .3844  .100 Uiso calc R 1 . . H
  C5  .1750(3)  .0682(4)  .2360(3)  .0707(10) Uani d . 1 . . C
  H5  .1171  .1130  .2386  .085 Uiso calc R 1 . . H
  C6  -.0567(4)  -.1308(5)  .0904(3)  .1015(15) Uani d D 1 . . C
  H6A1  -.0208  -.0883  .0513  .122 Uiso calc PR  .30 . . H
  H6A2  -.0743  -.0680  .1350  .122 Uiso calc PR  .30 . . H
  H6B1  -.0940  -.0648  .1185  .122 Uiso d PR  .70 . . H
  H6B2  .0037  -.1620  .1473  .122 Uiso d PR  .70 . . H
  C7A  -.0336(17)  -.2617(13)  .1212(13)  .114(6) Uani d PD  .30 . . C
  H7A1  -.0823  -.2957  .1482  .171 Uiso calc PR  .30 . . H
  H7A2  .0359  -.2661  .1745  .171 Uiso calc PR  .30 . . H
  H7A3  -.0378  -.3180  .0632  .171 Uiso calc PR  .30 . . H
  C7B  -.1228(7)  -.2399(10)  .0458(7)  .154(4) Uani d P  .70 . . C
  H7B1  -.0963  -.2934  .0039  .231 Uiso calc PR  .70 . . H
  H7B2  -.1909  -.2046  .0028  .231 Uiso calc PR  .70 . . H
  H7B3  -.1275  -.2980  .0993  .231 Uiso calc PR  .70 . . H
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
  Sn  .04618(18)  .0568(2)  .04256(17)  .00031(15)  .01699(13)  -.00217(14)
  Cl  .0636(5)  .0795(6)  .0643(5)  .0088(5)  .0175(4)  -.0177(5)
  N  .0537(16)  .0657(17)  .0539(15)  .0051(14)  .0155(13)  -.0065(13)
  C1  .054(2)  .077(2)  .066(2)  .0037(19)  .0176(18)  -.0129(19)
  C2  .057(2)  .083(2)  .084(3)  .012(2)  .014(2)  -.010(2)
  C3  .060(2)  .091(3)  .070(3)  .006(2)  -.0010(19)  .001(2)
  C4  .080(3)  .103(3)  .051(2)  .008(3)  .010(2)  -.011(2)
  C5  .064(2)  .084(2)  .057(2)  .012(2)  .0165(18)  -.0118(19)
  C6  .124(4)  .115(4)  .085(3)  -.030(3)  .062(3)  .000(3)
  C7A  .20(2)  .061(9)  .097(12)  .009(11)  .080(13)  .034(8)
  C7B  .150(8)  .161(9)  .141(8)  -.068(7)  .047(6)  .038(7)
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
  Sn C6 5 2.151(4) ?
  Sn C6 . 2.151(4) y
  Sn N 5 2.410(3) y
  Sn N . 2.411(3) y
  Sn Cl . 2.5910(10)  y
  Sn Cl 5 2.5910(10)  ?
  N C5 . 1.329(4) ?
  N C1 . 1.328(5) ?
  C1 C2 . 1.368(5) ?
  C2 C3 . 1.367(6) ?
  C3 C4 . 1.354(6) ?
  C4 C5 . 1.374(5) ?
  C6 C7A . 1.326(11) ?
  C6 C7B . 1.370(8) ?