The material described by N2(IBrCl)2 is Cyanogen Chloride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four ammonia atoms and four IBrCl clusters. In each IBrCl cluster, I(1) is bonded in a linear geometry to one Br(1) and one Cl(1) atom. Br(1) is bonded in a single-bond geometry to one I(1) atom. Cl(1) is bonded in a single-bond geometry to one I(1) atom. is represented by the CIF card [CIF]
data_IBrNCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.748
_cell_length_b   8.551
_cell_length_c   10.481
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   604.801
_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
  I  I0  1  0.250  0.037  0.135  1.0
  I  I1  1  0.250  0.463  0.635  1.0
  I  I2  1  0.750  0.963  0.865  1.0
  I  I3  1  0.750  0.537  0.365  1.0
  Br  Br4  1  0.250  0.233  0.940  1.0
  Br  Br5  1  0.250  0.267  0.440  1.0
  Br  Br6  1  0.750  0.767  0.060  1.0
  Br  Br7  1  0.750  0.733  0.560  1.0
  N  N8  1  0.750  0.459  0.846  1.0
  N  N9  1  0.750  0.041  0.346  1.0
  N  N10  1  0.250  0.541  0.154  1.0
  N  N11  1  0.250  0.959  0.654  1.0
  Cl  Cl12  1  0.250  0.859  0.322  1.0
  Cl  Cl13  1  0.250  0.641  0.822  1.0
  Cl  Cl14  1  0.750  0.141  0.678  1.0
  Cl  Cl15  1  0.750  0.359  0.178  1.0
[/CIF]
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The material described by N2(IBrCl)2 is Cyanogen Chloride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four ammonia atoms and four IBrCl clusters. In each IBrCl cluster, I(1) is bonded in a linear geometry to one Br(1) and one Cl(1) atom. Br(1) is bonded in a single-bond geometry to one I(1) atom. Cl(1) is bonded in a single-bond geometry to one I(1) atom. is represented by the CIF card [CIF]
data_IBrNCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.748
_cell_length_b   8.551
_cell_length_c   10.481
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   604.801
_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
  I  I0  1  0.250  0.037  0.135  1.0
  I  I1  1  0.250  0.463  0.635  1.0
  I  I2  1  0.750  0.963  0.865  1.0
  I  I3  1  0.750  0.537  0.365  1.0
  Br  Br4  1  0.250  0.233  0.940  1.0
  Br  Br5  1  0.250  0.267  0.440  1.0
  Br  Br6  1  0.750  0.767  0.060  1.0
  Br  Br7  1  0.750  0.733  0.560  1.0
  N  N8  1  0.750  0.459  0.846  1.0
  N  N9  1  0.750  0.041  0.346  1.0
  N  N10  1  0.250  0.541  0.154  1.0
  N  N11  1  0.250  0.959  0.654  1.0
  Cl  Cl12  1  0.250  0.859  0.322  1.0
  Cl  Cl13  1  0.250  0.641  0.822  1.0
  Cl  Cl14  1  0.750  0.141  0.678  1.0
  Cl  Cl15  1  0.750  0.359  0.178  1.0
[/CIF]
.