The compound described by Ti2In5 crystallizes in the tetragonal P4/mbm space group. Ti(1) is bonded to two equivalent Ti(1), two equivalent In(2), and eight equivalent In(1) atoms to form a mixture of edge, face, and corner-sharing TiTi2In10 cuboctahedra. There are two inequivalent In sites. In the first In site, In(2) is bonded in a distorted q6 geometry to four equivalent Ti(1), two equivalent In(2), and four equivalent In(1) atoms. In the second In site, In(1) is bonded in a 9-coordinate geometry to four equivalent Ti(1), one In(2), and four equivalent In(1) atoms. is represented by the CIF file [CIF]
data_Ti2In5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.932
_cell_length_b   10.932
_cell_length_c   3.138
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   375.010
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ti  Ti0  1  0.180  0.320  0.500  1.0
  Ti  Ti1  1  0.820  0.680  0.500  1.0
  Ti  Ti2  1  0.320  0.820  0.500  1.0
  Ti  Ti3  1  0.680  0.180  0.500  1.0
  In  In4  1  0.207  0.064  0.000  1.0
  In  In5  1  0.064  0.793  0.000  1.0
  In  In6  1  0.707  0.436  0.000  1.0
  In  In7  1  0.564  0.707  0.000  1.0
  In  In8  1  0.000  0.500  0.000  1.0
  In  In9  1  0.293  0.564  0.000  1.0
  In  In10  1  0.793  0.936  0.000  1.0
  In  In11  1  0.436  0.293  0.000  1.0
  In  In12  1  0.936  0.207  0.000  1.0
  In  In13  1  0.500  0.000  0.000  1.0
[/CIF]
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The compound described by Ti2In5 crystallizes in the tetragonal P4/mbm space group. Ti(1) is bonded to two equivalent Ti(1), two equivalent In(2), and eight equivalent In(1) atoms to form a mixture of edge, face, and corner-sharing TiTi2In10 cuboctahedra. There are two inequivalent In sites. In the first In site, In(2) is bonded in a distorted q6 geometry to four equivalent Ti(1), two equivalent In(2), and four equivalent In(1) atoms. In the second In site, In(1) is bonded in a 9-coordinate geometry to four equivalent Ti(1), one In(2), and four equivalent In(1) atoms. is represented by the CIF file [CIF]
data_Ti2In5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.932
_cell_length_b   10.932
_cell_length_c   3.138
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   375.010
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ti  Ti0  1  0.180  0.320  0.500  1.0
  Ti  Ti1  1  0.820  0.680  0.500  1.0
  Ti  Ti2  1  0.320  0.820  0.500  1.0
  Ti  Ti3  1  0.680  0.180  0.500  1.0
  In  In4  1  0.207  0.064  0.000  1.0
  In  In5  1  0.064  0.793  0.000  1.0
  In  In6  1  0.707  0.436  0.000  1.0
  In  In7  1  0.564  0.707  0.000  1.0
  In  In8  1  0.000  0.500  0.000  1.0
  In  In9  1  0.293  0.564  0.000  1.0
  In  In10  1  0.793  0.936  0.000  1.0
  In  In11  1  0.436  0.293  0.000  1.0
  In  In12  1  0.936  0.207  0.000  1.0
  In  In13  1  0.500  0.000  0.000  1.0
[/CIF]
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