The material described by RbSO3F crystallizes in the orthorhombic Pnma space group. Rb(1) is bonded in a 10-coordinate geometry to one O(2), six equivalent O(1), and three equivalent F(1) atoms. S(1) is bonded in a tetrahedral geometry to one O(2), two equivalent O(1), and one F(1) atom. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to three equivalent Rb(1) and one S(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Rb(1) and one S(1) atom. F(1) is bonded in a distorted single-bond geometry to three equivalent Rb(1) and one S(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_RbSO3F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.232
_cell_length_b   7.745
_cell_length_c   9.066
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   437.593
_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
  Rb  Rb0  1  0.250  0.342  0.825  1.0
  Rb  Rb1  1  0.250  0.158  0.325  1.0
  Rb  Rb2  1  0.750  0.658  0.175  1.0
  Rb  Rb3  1  0.750  0.842  0.675  1.0
  S  S4  1  0.250  0.802  0.939  1.0
  S  S5  1  0.250  0.698  0.439  1.0
  S  S6  1  0.750  0.198  0.061  1.0
  S  S7  1  0.750  0.302  0.561  1.0
  O  O8  1  0.053  0.706  0.912  1.0
  O  O9  1  0.447  0.794  0.412  1.0
  O  O10  1  0.553  0.294  0.088  1.0
  O  O11  1  0.947  0.206  0.588  1.0
  O  O12  1  0.947  0.294  0.088  1.0
  O  O13  1  0.553  0.206  0.588  1.0
  O  O14  1  0.447  0.706  0.912  1.0
  O  O15  1  0.053  0.794  0.412  1.0
  O  O16  1  0.250  0.913  0.067  1.0
  O  O17  1  0.250  0.587  0.567  1.0
  O  O18  1  0.750  0.087  0.933  1.0
  O  O19  1  0.750  0.413  0.433  1.0
  F  F20  1  0.250  0.942  0.800  1.0
  F  F21  1  0.250  0.558  0.300  1.0
  F  F22  1  0.750  0.058  0.200  1.0
  F  F23  1  0.750  0.442  0.700  1.0
[/CIF]
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The material described by RbSO3F crystallizes in the orthorhombic Pnma space group. Rb(1) is bonded in a 10-coordinate geometry to one O(2), six equivalent O(1), and three equivalent F(1) atoms. S(1) is bonded in a tetrahedral geometry to one O(2), two equivalent O(1), and one F(1) atom. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to three equivalent Rb(1) and one S(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Rb(1) and one S(1) atom. F(1) is bonded in a distorted single-bond geometry to three equivalent Rb(1) and one S(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_RbSO3F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.232
_cell_length_b   7.745
_cell_length_c   9.066
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   437.593
_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
  Rb  Rb0  1  0.250  0.342  0.825  1.0
  Rb  Rb1  1  0.250  0.158  0.325  1.0
  Rb  Rb2  1  0.750  0.658  0.175  1.0
  Rb  Rb3  1  0.750  0.842  0.675  1.0
  S  S4  1  0.250  0.802  0.939  1.0
  S  S5  1  0.250  0.698  0.439  1.0
  S  S6  1  0.750  0.198  0.061  1.0
  S  S7  1  0.750  0.302  0.561  1.0
  O  O8  1  0.053  0.706  0.912  1.0
  O  O9  1  0.447  0.794  0.412  1.0
  O  O10  1  0.553  0.294  0.088  1.0
  O  O11  1  0.947  0.206  0.588  1.0
  O  O12  1  0.947  0.294  0.088  1.0
  O  O13  1  0.553  0.206  0.588  1.0
  O  O14  1  0.447  0.706  0.912  1.0
  O  O15  1  0.053  0.794  0.412  1.0
  O  O16  1  0.250  0.913  0.067  1.0
  O  O17  1  0.250  0.587  0.567  1.0
  O  O18  1  0.750  0.087  0.933  1.0
  O  O19  1  0.750  0.413  0.433  1.0
  F  F20  1  0.250  0.942  0.800  1.0
  F  F21  1  0.250  0.558  0.300  1.0
  F  F22  1  0.750  0.058  0.200  1.0
  F  F23  1  0.750  0.442  0.700  1.0
[/CIF]
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