The material described by FeCl4ClN3 is Indium-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four tetrachloroferrat(iii) molecules and four ClN3 clusters. In each ClN3 cluster, there are two inequivalent N sites. In the first N site, N(2) is bonded in a single-bond geometry to one Cl(3) atom. In the second N site, N(1) is bonded in a single-bond geometry to one Cl(3) atom. Cl(3) is bonded in a trigonal planar geometry to one N(1) and two equivalent N(2) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_FeN3Cl5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.728
_cell_length_b   8.754
_cell_length_c   14.785
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1129.660
_cell_formula_units_Z   4
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  0.250  0.811  0.388  1.0
  Fe  Fe1  1  0.250  0.311  0.112  1.0
  Fe  Fe2  1  0.750  0.189  0.612  1.0
  Fe  Fe3  1  0.750  0.689  0.888  1.0
  N  N4  1  0.250  0.041  0.861  1.0
  N  N5  1  0.250  0.541  0.639  1.0
  N  N6  1  0.750  0.959  0.139  1.0
  N  N7  1  0.750  0.459  0.361  1.0
  N  N8  1  0.118  0.800  0.694  1.0
  N  N9  1  0.382  0.300  0.806  1.0
  N  N10  1  0.618  0.200  0.306  1.0
  N  N11  1  0.882  0.700  0.194  1.0
  N  N12  1  0.882  0.200  0.306  1.0
  N  N13  1  0.618  0.700  0.194  1.0
  N  N14  1  0.382  0.800  0.694  1.0
  N  N15  1  0.118  0.300  0.806  1.0
  Cl  Cl16  1  0.250  0.812  0.244  1.0
  Cl  Cl17  1  0.250  0.312  0.256  1.0
  Cl  Cl18  1  0.750  0.188  0.756  1.0
  Cl  Cl19  1  0.750  0.688  0.744  1.0
  Cl  Cl20  1  0.250  0.497  0.020  1.0
  Cl  Cl21  1  0.250  0.997  0.480  1.0
  Cl  Cl22  1  0.750  0.503  0.980  1.0
  Cl  Cl23  1  0.750  0.003  0.520  1.0
  Cl  Cl24  1  0.250  0.697  0.672  1.0
  Cl  Cl25  1  0.250  0.197  0.828  1.0
  Cl  Cl26  1  0.750  0.303  0.328  1.0
  Cl  Cl27  1  0.750  0.803  0.172  1.0
  Cl  Cl28  1  0.034  0.711  0.417  1.0
  Cl  Cl29  1  0.466  0.211  0.083  1.0
  Cl  Cl30  1  0.534  0.289  0.583  1.0
  Cl  Cl31  1  0.966  0.789  0.917  1.0
  Cl  Cl32  1  0.966  0.289  0.583  1.0
  Cl  Cl33  1  0.534  0.789  0.917  1.0
  Cl  Cl34  1  0.466  0.711  0.417  1.0
  Cl  Cl35  1  0.034  0.211  0.083  1.0
[/CIF]
.
The material described by FeCl4ClN3 is Indium-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four tetrachloroferrat(iii) molecules and four ClN3 clusters. In each ClN3 cluster, there are two inequivalent N sites. In the first N site, N(2) is bonded in a single-bond geometry to one Cl(3) atom. In the second N site, N(1) is bonded in a single-bond geometry to one Cl(3) atom. Cl(3) is bonded in a trigonal planar geometry to one N(1) and two equivalent N(2) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_FeN3Cl5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.728
_cell_length_b   8.754
_cell_length_c   14.785
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1129.660
_cell_formula_units_Z   4
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  0.250  0.811  0.388  1.0
  Fe  Fe1  1  0.250  0.311  0.112  1.0
  Fe  Fe2  1  0.750  0.189  0.612  1.0
  Fe  Fe3  1  0.750  0.689  0.888  1.0
  N  N4  1  0.250  0.041  0.861  1.0
  N  N5  1  0.250  0.541  0.639  1.0
  N  N6  1  0.750  0.959  0.139  1.0
  N  N7  1  0.750  0.459  0.361  1.0
  N  N8  1  0.118  0.800  0.694  1.0
  N  N9  1  0.382  0.300  0.806  1.0
  N  N10  1  0.618  0.200  0.306  1.0
  N  N11  1  0.882  0.700  0.194  1.0
  N  N12  1  0.882  0.200  0.306  1.0
  N  N13  1  0.618  0.700  0.194  1.0
  N  N14  1  0.382  0.800  0.694  1.0
  N  N15  1  0.118  0.300  0.806  1.0
  Cl  Cl16  1  0.250  0.812  0.244  1.0
  Cl  Cl17  1  0.250  0.312  0.256  1.0
  Cl  Cl18  1  0.750  0.188  0.756  1.0
  Cl  Cl19  1  0.750  0.688  0.744  1.0
  Cl  Cl20  1  0.250  0.497  0.020  1.0
  Cl  Cl21  1  0.250  0.997  0.480  1.0
  Cl  Cl22  1  0.750  0.503  0.980  1.0
  Cl  Cl23  1  0.750  0.003  0.520  1.0
  Cl  Cl24  1  0.250  0.697  0.672  1.0
  Cl  Cl25  1  0.250  0.197  0.828  1.0
  Cl  Cl26  1  0.750  0.303  0.328  1.0
  Cl  Cl27  1  0.750  0.803  0.172  1.0
  Cl  Cl28  1  0.034  0.711  0.417  1.0
  Cl  Cl29  1  0.466  0.211  0.083  1.0
  Cl  Cl30  1  0.534  0.289  0.583  1.0
  Cl  Cl31  1  0.966  0.789  0.917  1.0
  Cl  Cl32  1  0.966  0.289  0.583  1.0
  Cl  Cl33  1  0.534  0.789  0.917  1.0
  Cl  Cl34  1  0.466  0.711  0.417  1.0
  Cl  Cl35  1  0.034  0.211  0.083  1.0
[/CIF]
.