The material structure described by CAsO2ClF3 is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two CAsO2ClF3 clusters. C(1) is bonded in a distorted trigonal non-coplanar geometry to one As(1), one F(1), one F(2), and one F(3) atom. As(1) is bonded to one C(1), one O(1), two equivalent O(2), and one Cl(1) atom to form distorted edge-sharing AsCClO3 trigonal bipyramids. There are two inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one As(1) atom. In the second O site, O(2) is bonded in an L-shaped geometry to two equivalent As(1) atoms. Cl(1) is bonded in a single-bond geometry to one As(1) atom. There are three inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one C(1) atom. In the second F site, F(2) is bonded in a single-bond geometry to one C(1) atom. In the third F site, F(3) is bonded in a single-bond geometry to one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_AsCClO2F3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.670
_cell_length_b   5.369
_cell_length_c   12.809
_cell_angle_alpha   66.166
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   608.337
_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
  As  As0  1  0.373  0.610  0.458  1.0
  As  As1  1  0.127  0.610  0.958  1.0
  As  As2  1  0.627  0.390  0.542  1.0
  As  As3  1  0.873  0.390  0.042  1.0
  C  C4  1  0.390  0.907  0.292  1.0
  C  C5  1  0.110  0.907  0.792  1.0
  C  C6  1  0.610  0.093  0.708  1.0
  C  C7  1  0.890  0.093  0.208  1.0
  Cl  Cl8  1  0.161  0.445  0.431  1.0
  Cl  Cl9  1  0.339  0.445  0.931  1.0
  Cl  Cl10  1  0.839  0.555  0.569  1.0
  Cl  Cl11  1  0.661  0.555  0.069  1.0
  O  O12  1  0.264  0.664  0.553  1.0
  O  O13  1  0.236  0.664  0.053  1.0
  O  O14  1  0.736  0.336  0.447  1.0
  O  O15  1  0.764  0.336  0.947  1.0
  O  O16  1  0.541  0.708  0.508  1.0
  O  O17  1  0.959  0.708  0.008  1.0
  O  O18  1  0.459  0.292  0.492  1.0
  O  O19  1  0.041  0.292  0.992  1.0
  F  F20  1  0.447  0.128  0.300  1.0
  F  F21  1  0.053  0.128  0.800  1.0
  F  F22  1  0.553  0.872  0.700  1.0
  F  F23  1  0.947  0.872  0.200  1.0
  F  F24  1  0.473  0.815  0.231  1.0
  F  F25  1  0.027  0.815  0.731  1.0
  F  F26  1  0.527  0.185  0.769  1.0
  F  F27  1  0.973  0.185  0.269  1.0
  F  F28  1  0.266  0.970  0.243  1.0
  F  F29  1  0.234  0.970  0.743  1.0
  F  F30  1  0.734  0.030  0.757  1.0
  F  F31  1  0.766  0.030  0.257  1.0
[/CIF]
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The material structure described by CAsO2ClF3 is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two CAsO2ClF3 clusters. C(1) is bonded in a distorted trigonal non-coplanar geometry to one As(1), one F(1), one F(2), and one F(3) atom. As(1) is bonded to one C(1), one O(1), two equivalent O(2), and one Cl(1) atom to form distorted edge-sharing AsCClO3 trigonal bipyramids. There are two inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one As(1) atom. In the second O site, O(2) is bonded in an L-shaped geometry to two equivalent As(1) atoms. Cl(1) is bonded in a single-bond geometry to one As(1) atom. There are three inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one C(1) atom. In the second F site, F(2) is bonded in a single-bond geometry to one C(1) atom. In the third F site, F(3) is bonded in a single-bond geometry to one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_AsCClO2F3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.670
_cell_length_b   5.369
_cell_length_c   12.809
_cell_angle_alpha   66.166
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   608.337
_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
  As  As0  1  0.373  0.610  0.458  1.0
  As  As1  1  0.127  0.610  0.958  1.0
  As  As2  1  0.627  0.390  0.542  1.0
  As  As3  1  0.873  0.390  0.042  1.0
  C  C4  1  0.390  0.907  0.292  1.0
  C  C5  1  0.110  0.907  0.792  1.0
  C  C6  1  0.610  0.093  0.708  1.0
  C  C7  1  0.890  0.093  0.208  1.0
  Cl  Cl8  1  0.161  0.445  0.431  1.0
  Cl  Cl9  1  0.339  0.445  0.931  1.0
  Cl  Cl10  1  0.839  0.555  0.569  1.0
  Cl  Cl11  1  0.661  0.555  0.069  1.0
  O  O12  1  0.264  0.664  0.553  1.0
  O  O13  1  0.236  0.664  0.053  1.0
  O  O14  1  0.736  0.336  0.447  1.0
  O  O15  1  0.764  0.336  0.947  1.0
  O  O16  1  0.541  0.708  0.508  1.0
  O  O17  1  0.959  0.708  0.008  1.0
  O  O18  1  0.459  0.292  0.492  1.0
  O  O19  1  0.041  0.292  0.992  1.0
  F  F20  1  0.447  0.128  0.300  1.0
  F  F21  1  0.053  0.128  0.800  1.0
  F  F22  1  0.553  0.872  0.700  1.0
  F  F23  1  0.947  0.872  0.200  1.0
  F  F24  1  0.473  0.815  0.231  1.0
  F  F25  1  0.027  0.815  0.731  1.0
  F  F26  1  0.527  0.185  0.769  1.0
  F  F27  1  0.973  0.185  0.269  1.0
  F  F28  1  0.266  0.970  0.243  1.0
  F  F29  1  0.234  0.970  0.743  1.0
  F  F30  1  0.734  0.030  0.757  1.0
  F  F31  1  0.766  0.030  0.257  1.0
[/CIF]
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