The material structure described by Fe(CN)6 is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two ferrocyanic acid molecules. Fe(1) is bonded in an octahedral geometry to two equivalent C(1), two equivalent C(2), and two equivalent C(3) atoms. There are three inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one Fe(1) and one N(3) atom. In the second C site, C(2) is bonded in a linear geometry to one Fe(1) and one N(2) atom. In the third C site, C(3) is bonded in a linear geometry to one Fe(1) and one N(1) atom. There are three inequivalent N sites. In the first N site, N(1) is bonded in a single-bond geometry to one C(3) atom. In the second N site, N(2) is bonded in a single-bond geometry to one C(2) atom. In the third N site, N(3) is bonded in a single-bond geometry to one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Fe(CN)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.479
_cell_length_b   7.302
_cell_length_c   11.910
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   105.789
_symmetry_Int_Tables_number   1
_cell_volume   542.219
_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
  Fe  Fe0  1  0.000  0.000  0.000  1.0
  Fe  Fe1  1  0.000  0.500  0.500  1.0
  C  C2  1  0.816  0.459  0.371  1.0
  C  C3  1  0.184  0.541  0.629  1.0
  C  C4  1  0.184  0.041  0.871  1.0
  C  C5  1  0.816  0.959  0.129  1.0
  C  C6  1  0.784  0.812  0.925  1.0
  C  C7  1  0.216  0.188  0.075  1.0
  C  C8  1  0.216  0.688  0.425  1.0
  C  C9  1  0.784  0.312  0.575  1.0
  C  C10  1  0.872  0.694  0.548  1.0
  C  C11  1  0.128  0.306  0.452  1.0
  C  C12  1  0.128  0.806  0.048  1.0
  C  C13  1  0.872  0.194  0.952  1.0
  N  N14  1  0.796  0.814  0.578  1.0
  N  N15  1  0.204  0.186  0.422  1.0
  N  N16  1  0.204  0.686  0.078  1.0
  N  N17  1  0.796  0.314  0.922  1.0
  N  N18  1  0.653  0.691  0.878  1.0
  N  N19  1  0.347  0.309  0.122  1.0
  N  N20  1  0.347  0.809  0.378  1.0
  N  N21  1  0.653  0.191  0.622  1.0
  N  N22  1  0.710  0.934  0.211  1.0
  N  N23  1  0.290  0.066  0.789  1.0
  N  N24  1  0.290  0.566  0.711  1.0
  N  N25  1  0.710  0.434  0.289  1.0
[/CIF]
.
The material structure described by Fe(CN)6 is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two ferrocyanic acid molecules. Fe(1) is bonded in an octahedral geometry to two equivalent C(1), two equivalent C(2), and two equivalent C(3) atoms. There are three inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one Fe(1) and one N(3) atom. In the second C site, C(2) is bonded in a linear geometry to one Fe(1) and one N(2) atom. In the third C site, C(3) is bonded in a linear geometry to one Fe(1) and one N(1) atom. There are three inequivalent N sites. In the first N site, N(1) is bonded in a single-bond geometry to one C(3) atom. In the second N site, N(2) is bonded in a single-bond geometry to one C(2) atom. In the third N site, N(3) is bonded in a single-bond geometry to one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Fe(CN)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.479
_cell_length_b   7.302
_cell_length_c   11.910
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   105.789
_symmetry_Int_Tables_number   1
_cell_volume   542.219
_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
  Fe  Fe0  1  0.000  0.000  0.000  1.0
  Fe  Fe1  1  0.000  0.500  0.500  1.0
  C  C2  1  0.816  0.459  0.371  1.0
  C  C3  1  0.184  0.541  0.629  1.0
  C  C4  1  0.184  0.041  0.871  1.0
  C  C5  1  0.816  0.959  0.129  1.0
  C  C6  1  0.784  0.812  0.925  1.0
  C  C7  1  0.216  0.188  0.075  1.0
  C  C8  1  0.216  0.688  0.425  1.0
  C  C9  1  0.784  0.312  0.575  1.0
  C  C10  1  0.872  0.694  0.548  1.0
  C  C11  1  0.128  0.306  0.452  1.0
  C  C12  1  0.128  0.806  0.048  1.0
  C  C13  1  0.872  0.194  0.952  1.0
  N  N14  1  0.796  0.814  0.578  1.0
  N  N15  1  0.204  0.186  0.422  1.0
  N  N16  1  0.204  0.686  0.078  1.0
  N  N17  1  0.796  0.314  0.922  1.0
  N  N18  1  0.653  0.691  0.878  1.0
  N  N19  1  0.347  0.309  0.122  1.0
  N  N20  1  0.347  0.809  0.378  1.0
  N  N21  1  0.653  0.191  0.622  1.0
  N  N22  1  0.710  0.934  0.211  1.0
  N  N23  1  0.290  0.066  0.789  1.0
  N  N24  1  0.290  0.566  0.711  1.0
  N  N25  1  0.710  0.434  0.289  1.0
[/CIF]
.