The compound described by FeCd2(CN)6 crystallizes in the trigonal P-31m space group. Fe(1) is bonded in an octahedral geometry to six equivalent C(1) atoms. Cd(1) is bonded to six equivalent N(1) atoms to form edge-sharing CdN6 octahedra. C(1) is bonded in a linear geometry to one Fe(1) and one N(1) atom. N(1) is bonded in a distorted trigonal planar geometry to two equivalent Cd(1) and one C(1) atom. is represented by the CIF card [CIF]
data_Cd2Fe(CN)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.382
_cell_length_b   6.382
_cell_length_c   6.378
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   224.956
_cell_formula_units_Z   1
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
  Cd  Cd0  1  0.333  0.667  0.500  1.0
  Cd  Cd1  1  0.667  0.333  0.500  1.0
  Fe  Fe2  1  0.000  0.000  0.000  1.0
  C  C3  1  0.767  0.767  0.177  1.0
  C  C4  1  0.000  0.233  0.177  1.0
  C  C5  1  0.233  0.233  0.823  1.0
  C  C6  1  0.233  0.000  0.177  1.0
  C  C7  1  0.000  0.767  0.823  1.0
  C  C8  1  0.767  0.000  0.823  1.0
  N  N9  1  0.627  0.627  0.299  1.0
  N  N10  1  0.000  0.373  0.299  1.0
  N  N11  1  0.373  0.000  0.299  1.0
  N  N12  1  0.627  0.000  0.701  1.0
  N  N13  1  0.000  0.627  0.701  1.0
  N  N14  1  0.373  0.373  0.701  1.0
[/CIF]
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The compound described by FeCd2(CN)6 crystallizes in the trigonal P-31m space group. Fe(1) is bonded in an octahedral geometry to six equivalent C(1) atoms. Cd(1) is bonded to six equivalent N(1) atoms to form edge-sharing CdN6 octahedra. C(1) is bonded in a linear geometry to one Fe(1) and one N(1) atom. N(1) is bonded in a distorted trigonal planar geometry to two equivalent Cd(1) and one C(1) atom. is represented by the CIF card [CIF]
data_Cd2Fe(CN)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.382
_cell_length_b   6.382
_cell_length_c   6.378
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   224.956
_cell_formula_units_Z   1
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
  Cd  Cd0  1  0.333  0.667  0.500  1.0
  Cd  Cd1  1  0.667  0.333  0.500  1.0
  Fe  Fe2  1  0.000  0.000  0.000  1.0
  C  C3  1  0.767  0.767  0.177  1.0
  C  C4  1  0.000  0.233  0.177  1.0
  C  C5  1  0.233  0.233  0.823  1.0
  C  C6  1  0.233  0.000  0.177  1.0
  C  C7  1  0.000  0.767  0.823  1.0
  C  C8  1  0.767  0.000  0.823  1.0
  N  N9  1  0.627  0.627  0.299  1.0
  N  N10  1  0.000  0.373  0.299  1.0
  N  N11  1  0.373  0.000  0.299  1.0
  N  N12  1  0.627  0.000  0.701  1.0
  N  N13  1  0.000  0.627  0.701  1.0
  N  N14  1  0.373  0.373  0.701  1.0
[/CIF]
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