The structure described by Cs2CrO4Cl5 crystallizes in the monoclinic C2/m space group. Cs(1) is bonded in a 8-coordinate geometry to one Cl(3), three equivalent Cl(2), and four equivalent Cl(1) atoms. Cr(1) is bonded in a distorted octahedral geometry to four equivalent O(1) and two equivalent Cl(2) atoms. O(1) is bonded in a single-bond geometry to one Cr(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a distorted rectangular see-saw-like geometry to four equivalent Cs(1) atoms. In the second Cl site, Cl(2) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one Cr(1) atom. In the third Cl site, Cl(3) is bonded in a linear geometry to two equivalent Cs(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cs2CrCl5O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.646
_cell_length_b   7.026
_cell_length_c   9.143
_cell_angle_alpha   107.746
_cell_angle_beta   107.985
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   326.763
_cell_formula_units_Z   1
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
  Cs  Cs0  1  0.700  0.731  0.401  1.0
  Cs  Cs1  1  0.300  0.269  0.599  1.0
  Cr  Cr2  1  0.000  0.000  0.000  1.0
  Cl  Cl3  1  0.665  0.210  0.330  1.0
  Cl  Cl4  1  0.335  0.790  0.670  1.0
  Cl  Cl5  1  0.108  0.864  0.216  1.0
  Cl  Cl6  1  0.892  0.136  0.784  1.0
  Cl  Cl7  1  0.500  0.500  0.000  1.0
  O  O8  1  0.161  0.805  0.899  1.0
  O  O9  1  0.738  0.805  0.899  1.0
  O  O10  1  0.839  0.195  0.101  1.0
  O  O11  1  0.262  0.195  0.101  1.0
[/CIF]
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The structure described by Cs2CrO4Cl5 crystallizes in the monoclinic C2/m space group. Cs(1) is bonded in a 8-coordinate geometry to one Cl(3), three equivalent Cl(2), and four equivalent Cl(1) atoms. Cr(1) is bonded in a distorted octahedral geometry to four equivalent O(1) and two equivalent Cl(2) atoms. O(1) is bonded in a single-bond geometry to one Cr(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a distorted rectangular see-saw-like geometry to four equivalent Cs(1) atoms. In the second Cl site, Cl(2) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one Cr(1) atom. In the third Cl site, Cl(3) is bonded in a linear geometry to two equivalent Cs(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cs2CrCl5O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.646
_cell_length_b   7.026
_cell_length_c   9.143
_cell_angle_alpha   107.746
_cell_angle_beta   107.985
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   326.763
_cell_formula_units_Z   1
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
  Cs  Cs0  1  0.700  0.731  0.401  1.0
  Cs  Cs1  1  0.300  0.269  0.599  1.0
  Cr  Cr2  1  0.000  0.000  0.000  1.0
  Cl  Cl3  1  0.665  0.210  0.330  1.0
  Cl  Cl4  1  0.335  0.790  0.670  1.0
  Cl  Cl5  1  0.108  0.864  0.216  1.0
  Cl  Cl6  1  0.892  0.136  0.784  1.0
  Cl  Cl7  1  0.500  0.500  0.000  1.0
  O  O8  1  0.161  0.805  0.899  1.0
  O  O9  1  0.738  0.805  0.899  1.0
  O  O10  1  0.839  0.195  0.101  1.0
  O  O11  1  0.262  0.195  0.101  1.0
[/CIF]
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