The compound described by K2RuOCl5 crystallizes in the orthorhombic Pnma space group. K(1) is bonded in a 9-coordinate geometry to two equivalent Cl(1), two equivalent Cl(2), two equivalent Cl(3), and three equivalent Cl(4) atoms. Ru(1) is bonded in a distorted octahedral geometry to one O(1), one Cl(1), one Cl(2), one Cl(3), and two equivalent Cl(4) atoms. O(1) is bonded in a single-bond geometry to one Ru(1) atom. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded to four equivalent K(1) and one Ru(1) atom to form a mixture of distorted corner, edge, and face-sharing ClK4Ru square pyramids. In the second Cl site, Cl(2) is bonded to four equivalent K(1) and one Ru(1) atom to form a mixture of corner, edge, and face-sharing ClK4Ru square pyramids. In the third Cl site, Cl(3) is bonded in a 5-coordinate geometry to four equivalent K(1) and one Ru(1) atom. In the fourth Cl site, Cl(4) is bonded in a 4-coordinate geometry to three equivalent K(1) and one Ru(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_K2RuCl5O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.170
_cell_length_b   9.644
_cell_length_c   13.587
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   939.451
_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
  K  K0  1  0.351  0.499  0.147  1.0
  K  K1  1  0.149  0.001  0.647  1.0
  K  K2  1  0.649  0.999  0.853  1.0
  K  K3  1  0.851  0.501  0.353  1.0
  K  K4  1  0.649  0.501  0.853  1.0
  K  K5  1  0.851  0.999  0.353  1.0
  K  K6  1  0.351  0.001  0.147  1.0
  K  K7  1  0.149  0.499  0.647  1.0
  Ru  Ru8  1  0.827  0.750  0.095  1.0
  Ru  Ru9  1  0.673  0.750  0.595  1.0
  Ru  Ru10  1  0.173  0.250  0.905  1.0
  Ru  Ru11  1  0.327  0.250  0.405  1.0
  Cl  Cl12  1  0.542  0.750  0.001  1.0
  Cl  Cl13  1  0.958  0.750  0.501  1.0
  Cl  Cl14  1  0.458  0.250  0.999  1.0
  Cl  Cl15  1  0.042  0.250  0.499  1.0
  Cl  Cl16  1  0.616  0.750  0.243  1.0
  Cl  Cl17  1  0.884  0.750  0.743  1.0
  Cl  Cl18  1  0.384  0.250  0.757  1.0
  Cl  Cl19  1  0.116  0.250  0.257  1.0
  Cl  Cl20  1  0.079  0.750  0.211  1.0
  Cl  Cl21  1  0.421  0.750  0.711  1.0
  Cl  Cl22  1  0.921  0.250  0.789  1.0
  Cl  Cl23  1  0.579  0.250  0.289  1.0
  Cl  Cl24  1  0.812  0.506  0.107  1.0
  Cl  Cl25  1  0.688  0.994  0.607  1.0
  Cl  Cl26  1  0.188  0.006  0.893  1.0
  Cl  Cl27  1  0.312  0.494  0.393  1.0
  Cl  Cl28  1  0.188  0.494  0.893  1.0
  Cl  Cl29  1  0.312  0.006  0.393  1.0
  Cl  Cl30  1  0.812  0.994  0.107  1.0
  Cl  Cl31  1  0.688  0.506  0.607  1.0
  O  O32  1  0.966  0.750  0.992  1.0
  O  O33  1  0.534  0.750  0.492  1.0
  O  O34  1  0.034  0.250  0.008  1.0
  O  O35  1  0.466  0.250  0.508  1.0
[/CIF]
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The compound described by K2RuOCl5 crystallizes in the orthorhombic Pnma space group. K(1) is bonded in a 9-coordinate geometry to two equivalent Cl(1), two equivalent Cl(2), two equivalent Cl(3), and three equivalent Cl(4) atoms. Ru(1) is bonded in a distorted octahedral geometry to one O(1), one Cl(1), one Cl(2), one Cl(3), and two equivalent Cl(4) atoms. O(1) is bonded in a single-bond geometry to one Ru(1) atom. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded to four equivalent K(1) and one Ru(1) atom to form a mixture of distorted corner, edge, and face-sharing ClK4Ru square pyramids. In the second Cl site, Cl(2) is bonded to four equivalent K(1) and one Ru(1) atom to form a mixture of corner, edge, and face-sharing ClK4Ru square pyramids. In the third Cl site, Cl(3) is bonded in a 5-coordinate geometry to four equivalent K(1) and one Ru(1) atom. In the fourth Cl site, Cl(4) is bonded in a 4-coordinate geometry to three equivalent K(1) and one Ru(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_K2RuCl5O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.170
_cell_length_b   9.644
_cell_length_c   13.587
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   939.451
_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
  K  K0  1  0.351  0.499  0.147  1.0
  K  K1  1  0.149  0.001  0.647  1.0
  K  K2  1  0.649  0.999  0.853  1.0
  K  K3  1  0.851  0.501  0.353  1.0
  K  K4  1  0.649  0.501  0.853  1.0
  K  K5  1  0.851  0.999  0.353  1.0
  K  K6  1  0.351  0.001  0.147  1.0
  K  K7  1  0.149  0.499  0.647  1.0
  Ru  Ru8  1  0.827  0.750  0.095  1.0
  Ru  Ru9  1  0.673  0.750  0.595  1.0
  Ru  Ru10  1  0.173  0.250  0.905  1.0
  Ru  Ru11  1  0.327  0.250  0.405  1.0
  Cl  Cl12  1  0.542  0.750  0.001  1.0
  Cl  Cl13  1  0.958  0.750  0.501  1.0
  Cl  Cl14  1  0.458  0.250  0.999  1.0
  Cl  Cl15  1  0.042  0.250  0.499  1.0
  Cl  Cl16  1  0.616  0.750  0.243  1.0
  Cl  Cl17  1  0.884  0.750  0.743  1.0
  Cl  Cl18  1  0.384  0.250  0.757  1.0
  Cl  Cl19  1  0.116  0.250  0.257  1.0
  Cl  Cl20  1  0.079  0.750  0.211  1.0
  Cl  Cl21  1  0.421  0.750  0.711  1.0
  Cl  Cl22  1  0.921  0.250  0.789  1.0
  Cl  Cl23  1  0.579  0.250  0.289  1.0
  Cl  Cl24  1  0.812  0.506  0.107  1.0
  Cl  Cl25  1  0.688  0.994  0.607  1.0
  Cl  Cl26  1  0.188  0.006  0.893  1.0
  Cl  Cl27  1  0.312  0.494  0.393  1.0
  Cl  Cl28  1  0.188  0.494  0.893  1.0
  Cl  Cl29  1  0.312  0.006  0.393  1.0
  Cl  Cl30  1  0.812  0.994  0.107  1.0
  Cl  Cl31  1  0.688  0.506  0.607  1.0
  O  O32  1  0.966  0.750  0.992  1.0
  O  O33  1  0.534  0.750  0.492  1.0
  O  O34  1  0.034  0.250  0.008  1.0
  O  O35  1  0.466  0.250  0.508  1.0
[/CIF]
.