The structure described by BP(IBr)3 is Silicon tetrafluoride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four BP(IBr)3 clusters. B(1) is bonded in a tetrahedral geometry to one P(1), one Br(2), and two equivalent Br(1) atoms. P(1) is bonded in a tetrahedral geometry to one B(1) and three equivalent I(1,2) atoms. I(1,2) is bonded in a single-bond geometry to one P(1) atom. There are two inequivalent Br sites. In the first Br site, Br(1) is bonded in a single-bond geometry to one B(1) atom. In the second Br site, Br(2) is bonded in a single-bond geometry to one B(1) atom. is represented by the CIF card [CIF]
data_BP(IBr)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.965
_cell_length_b   12.000
_cell_length_c   13.639
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1303.619
_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
  B  B0  1  0.250  0.750  0.106  1.0
  B  B1  1  0.750  0.250  0.394  1.0
  B  B2  1  0.750  0.250  0.894  1.0
  B  B3  1  0.250  0.750  0.606  1.0
  P  P4  1  0.501  0.750  0.140  1.0
  P  P5  1  0.001  0.250  0.360  1.0
  P  P6  1  0.499  0.250  0.860  1.0
  P  P7  1  0.999  0.750  0.640  1.0
  I  I8  1  0.178  0.250  0.505  1.0
  I  I9  1  0.322  0.250  0.005  1.0
  I  I10  1  0.080  0.413  0.264  1.0
  I  I11  1  0.420  0.087  0.764  1.0
  I  I12  1  0.580  0.913  0.236  1.0
  I  I13  1  0.420  0.413  0.764  1.0
  I  I14  1  0.822  0.750  0.495  1.0
  I  I15  1  0.920  0.913  0.736  1.0
  I  I16  1  0.580  0.587  0.236  1.0
  I  I17  1  0.678  0.750  0.995  1.0
  I  I18  1  0.080  0.087  0.264  1.0
  I  I19  1  0.920  0.587  0.736  1.0
  Br  Br20  1  0.283  0.610  0.529  1.0
  Br  Br21  1  0.717  0.110  0.471  1.0
  Br  Br22  1  0.634  0.250  0.264  1.0
  Br  Br23  1  0.783  0.110  0.971  1.0
  Br  Br24  1  0.366  0.750  0.736  1.0
  Br  Br25  1  0.217  0.890  0.029  1.0
  Br  Br26  1  0.783  0.390  0.971  1.0
  Br  Br27  1  0.283  0.890  0.529  1.0
  Br  Br28  1  0.866  0.250  0.764  1.0
  Br  Br29  1  0.134  0.750  0.236  1.0
  Br  Br30  1  0.717  0.390  0.471  1.0
  Br  Br31  1  0.217  0.610  0.029  1.0
[/CIF]
.
The structure described by BP(IBr)3 is Silicon tetrafluoride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four BP(IBr)3 clusters. B(1) is bonded in a tetrahedral geometry to one P(1), one Br(2), and two equivalent Br(1) atoms. P(1) is bonded in a tetrahedral geometry to one B(1) and three equivalent I(1,2) atoms. I(1,2) is bonded in a single-bond geometry to one P(1) atom. There are two inequivalent Br sites. In the first Br site, Br(1) is bonded in a single-bond geometry to one B(1) atom. In the second Br site, Br(2) is bonded in a single-bond geometry to one B(1) atom. is represented by the CIF card [CIF]
data_BP(IBr)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.965
_cell_length_b   12.000
_cell_length_c   13.639
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1303.619
_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
  B  B0  1  0.250  0.750  0.106  1.0
  B  B1  1  0.750  0.250  0.394  1.0
  B  B2  1  0.750  0.250  0.894  1.0
  B  B3  1  0.250  0.750  0.606  1.0
  P  P4  1  0.501  0.750  0.140  1.0
  P  P5  1  0.001  0.250  0.360  1.0
  P  P6  1  0.499  0.250  0.860  1.0
  P  P7  1  0.999  0.750  0.640  1.0
  I  I8  1  0.178  0.250  0.505  1.0
  I  I9  1  0.322  0.250  0.005  1.0
  I  I10  1  0.080  0.413  0.264  1.0
  I  I11  1  0.420  0.087  0.764  1.0
  I  I12  1  0.580  0.913  0.236  1.0
  I  I13  1  0.420  0.413  0.764  1.0
  I  I14  1  0.822  0.750  0.495  1.0
  I  I15  1  0.920  0.913  0.736  1.0
  I  I16  1  0.580  0.587  0.236  1.0
  I  I17  1  0.678  0.750  0.995  1.0
  I  I18  1  0.080  0.087  0.264  1.0
  I  I19  1  0.920  0.587  0.736  1.0
  Br  Br20  1  0.283  0.610  0.529  1.0
  Br  Br21  1  0.717  0.110  0.471  1.0
  Br  Br22  1  0.634  0.250  0.264  1.0
  Br  Br23  1  0.783  0.110  0.971  1.0
  Br  Br24  1  0.366  0.750  0.736  1.0
  Br  Br25  1  0.217  0.890  0.029  1.0
  Br  Br26  1  0.783  0.390  0.971  1.0
  Br  Br27  1  0.283  0.890  0.529  1.0
  Br  Br28  1  0.866  0.250  0.764  1.0
  Br  Br29  1  0.134  0.750  0.236  1.0
  Br  Br30  1  0.717  0.390  0.471  1.0
  Br  Br31  1  0.217  0.610  0.029  1.0
[/CIF]
.