The compound described by RbCo(O2Br)3 crystallizes in the monoclinic C2/c space group. Rb(1) is bonded in a distorted bent 150 degrees geometry to two equivalent O(3) and two equivalent Br(2) atoms. Co(1) is bonded in an octahedral geometry to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one Co(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Co(1) and one Br(2) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one Rb(1), one Co(1), and one Br(1) atom. There are two inequivalent Br sites. In the first Br site, Br(1) is bonded in a linear geometry to two equivalent O(3) atoms. In the second Br site, Br(2) is bonded in a distorted single-bond geometry to one Rb(1) and one O(2) atom. is represented by the CIF file [CIF]
data_RbCo(BrO2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.372
_cell_length_b   6.372
_cell_length_c   14.229
_cell_angle_alpha   83.443
_cell_angle_beta   83.443
_cell_angle_gamma   120.640
_symmetry_Int_Tables_number   1
_cell_volume   483.674
_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
  Rb  Rb0  1  0.390  0.610  0.750  1.0
  Rb  Rb1  1  0.610  0.390  0.250  1.0
  Co  Co2  1  0.000  0.000  0.000  1.0
  Co  Co3  1  0.000  0.000  0.500  1.0
  Br  Br4  1  0.500  0.500  0.000  1.0
  Br  Br5  1  0.500  0.500  0.500  1.0
  Br  Br6  1  0.497  0.069  0.874  1.0
  Br  Br7  1  0.503  0.931  0.126  1.0
  Br  Br8  1  0.931  0.503  0.626  1.0
  Br  Br9  1  0.069  0.497  0.374  1.0
  O  O10  1  0.870  0.947  0.897  1.0
  O  O11  1  0.130  0.053  0.103  1.0
  O  O12  1  0.053  0.130  0.603  1.0
  O  O13  1  0.947  0.870  0.397  1.0
  O  O14  1  0.190  0.867  0.948  1.0
  O  O15  1  0.810  0.133  0.052  1.0
  O  O16  1  0.133  0.810  0.552  1.0
  O  O17  1  0.867  0.190  0.448  1.0
  O  O18  1  0.677  0.767  0.567  1.0
  O  O19  1  0.323  0.233  0.433  1.0
  O  O20  1  0.233  0.323  0.933  1.0
  O  O21  1  0.767  0.677  0.067  1.0
[/CIF]
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The compound described by RbCo(O2Br)3 crystallizes in the monoclinic C2/c space group. Rb(1) is bonded in a distorted bent 150 degrees geometry to two equivalent O(3) and two equivalent Br(2) atoms. Co(1) is bonded in an octahedral geometry to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one Co(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Co(1) and one Br(2) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one Rb(1), one Co(1), and one Br(1) atom. There are two inequivalent Br sites. In the first Br site, Br(1) is bonded in a linear geometry to two equivalent O(3) atoms. In the second Br site, Br(2) is bonded in a distorted single-bond geometry to one Rb(1) and one O(2) atom. is represented by the CIF file [CIF]
data_RbCo(BrO2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.372
_cell_length_b   6.372
_cell_length_c   14.229
_cell_angle_alpha   83.443
_cell_angle_beta   83.443
_cell_angle_gamma   120.640
_symmetry_Int_Tables_number   1
_cell_volume   483.674
_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
  Rb  Rb0  1  0.390  0.610  0.750  1.0
  Rb  Rb1  1  0.610  0.390  0.250  1.0
  Co  Co2  1  0.000  0.000  0.000  1.0
  Co  Co3  1  0.000  0.000  0.500  1.0
  Br  Br4  1  0.500  0.500  0.000  1.0
  Br  Br5  1  0.500  0.500  0.500  1.0
  Br  Br6  1  0.497  0.069  0.874  1.0
  Br  Br7  1  0.503  0.931  0.126  1.0
  Br  Br8  1  0.931  0.503  0.626  1.0
  Br  Br9  1  0.069  0.497  0.374  1.0
  O  O10  1  0.870  0.947  0.897  1.0
  O  O11  1  0.130  0.053  0.103  1.0
  O  O12  1  0.053  0.130  0.603  1.0
  O  O13  1  0.947  0.870  0.397  1.0
  O  O14  1  0.190  0.867  0.948  1.0
  O  O15  1  0.810  0.133  0.052  1.0
  O  O16  1  0.133  0.810  0.552  1.0
  O  O17  1  0.867  0.190  0.448  1.0
  O  O18  1  0.677  0.767  0.567  1.0
  O  O19  1  0.323  0.233  0.433  1.0
  O  O20  1  0.233  0.323  0.933  1.0
  O  O21  1  0.767  0.677  0.067  1.0
[/CIF]
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