The compound described by FeN3O3Cl is Indium-like structured and crystallizes in the hexagonal P6_3mc space group. The structure is zero-dimensional and consists of two FeN3O3Cl clusters. Fe(1) is bonded in a tetrahedral geometry to three equivalent N(1) and one Cl(1) atom. N(1) is bonded in a bent 150 degrees geometry to one Fe(1) and one O(1) atom. O(1) is bonded in a single-bond geometry to one N(1) atom. Cl(1) is bonded in a single-bond geometry to one Fe(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_FeN3ClO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.712
_cell_length_b   7.712
_cell_length_c   6.326
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   325.850
_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  0.333  0.667  0.787  1.0
  Fe  Fe1  1  0.667  0.333  0.287  1.0
  N  N2  1  0.794  0.206  0.183  1.0
  N  N3  1  0.589  0.794  0.683  1.0
  N  N4  1  0.206  0.794  0.683  1.0
  N  N5  1  0.411  0.206  0.183  1.0
  N  N6  1  0.794  0.589  0.183  1.0
  N  N7  1  0.206  0.411  0.683  1.0
  Cl  Cl8  1  0.333  0.667  0.146  1.0
  Cl  Cl9  1  0.667  0.333  0.646  1.0
  O  O10  1  0.862  0.138  0.064  1.0
  O  O11  1  0.138  0.277  0.564  1.0
  O  O12  1  0.138  0.862  0.564  1.0
  O  O13  1  0.277  0.138  0.064  1.0
  O  O14  1  0.723  0.862  0.564  1.0
  O  O15  1  0.862  0.723  0.064  1.0
[/CIF]
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The compound described by FeN3O3Cl is Indium-like structured and crystallizes in the hexagonal P6_3mc space group. The structure is zero-dimensional and consists of two FeN3O3Cl clusters. Fe(1) is bonded in a tetrahedral geometry to three equivalent N(1) and one Cl(1) atom. N(1) is bonded in a bent 150 degrees geometry to one Fe(1) and one O(1) atom. O(1) is bonded in a single-bond geometry to one N(1) atom. Cl(1) is bonded in a single-bond geometry to one Fe(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_FeN3ClO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.712
_cell_length_b   7.712
_cell_length_c   6.326
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   325.850
_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  0.333  0.667  0.787  1.0
  Fe  Fe1  1  0.667  0.333  0.287  1.0
  N  N2  1  0.794  0.206  0.183  1.0
  N  N3  1  0.589  0.794  0.683  1.0
  N  N4  1  0.206  0.794  0.683  1.0
  N  N5  1  0.411  0.206  0.183  1.0
  N  N6  1  0.794  0.589  0.183  1.0
  N  N7  1  0.206  0.411  0.683  1.0
  Cl  Cl8  1  0.333  0.667  0.146  1.0
  Cl  Cl9  1  0.667  0.333  0.646  1.0
  O  O10  1  0.862  0.138  0.064  1.0
  O  O11  1  0.138  0.277  0.564  1.0
  O  O12  1  0.138  0.862  0.564  1.0
  O  O13  1  0.277  0.138  0.064  1.0
  O  O14  1  0.723  0.862  0.564  1.0
  O  O15  1  0.862  0.723  0.064  1.0
[/CIF]
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