The compound described by P2O3F4 is Indium-like structured and crystallizes in the orthorhombic Pcca space group. The structure is zero-dimensional and consists of four pyrophosphoryl tetrafluoride molecules. P(1) is bonded to one O(1), one O(2), one F(1), and one F(2) atom to form corner-sharing PO2F2 tetrahedra. There are two inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one P(1) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to two equivalent P(1) atoms. There are two inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one P(1) atom. In the second F site, F(2) is bonded in a single-bond geometry to one P(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_P2O3F4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.357
_cell_length_b   6.410
_cell_length_c   12.187
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   496.625
_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
  P  P0  1  0.121  0.310  0.899  1.0
  P  P1  1  0.121  0.690  0.601  1.0
  P  P2  1  0.379  0.690  0.399  1.0
  P  P3  1  0.379  0.310  0.101  1.0
  P  P4  1  0.879  0.690  0.101  1.0
  P  P5  1  0.879  0.310  0.399  1.0
  P  P6  1  0.621  0.310  0.601  1.0
  P  P7  1  0.621  0.690  0.899  1.0
  O  O8  1  0.080  0.530  0.888  1.0
  O  O9  1  0.080  0.470  0.612  1.0
  O  O10  1  0.420  0.470  0.388  1.0
  O  O11  1  0.420  0.530  0.112  1.0
  O  O12  1  0.920  0.470  0.112  1.0
  O  O13  1  0.920  0.530  0.388  1.0
  O  O14  1  0.580  0.530  0.612  1.0
  O  O15  1  0.580  0.470  0.888  1.0
  O  O16  1  0.250  0.229  0.000  1.0
  O  O17  1  0.250  0.771  0.500  1.0
  O  O18  1  0.750  0.771  0.000  1.0
  O  O19  1  0.750  0.229  0.500  1.0
  F  F20  1  0.929  0.167  0.906  1.0
  F  F21  1  0.929  0.833  0.594  1.0
  F  F22  1  0.571  0.833  0.406  1.0
  F  F23  1  0.571  0.167  0.094  1.0
  F  F24  1  0.071  0.833  0.094  1.0
  F  F25  1  0.071  0.167  0.406  1.0
  F  F26  1  0.429  0.167  0.594  1.0
  F  F27  1  0.429  0.833  0.906  1.0
  F  F28  1  0.239  0.207  0.804  1.0
  F  F29  1  0.239  0.793  0.696  1.0
  F  F30  1  0.261  0.793  0.304  1.0
  F  F31  1  0.261  0.207  0.196  1.0
  F  F32  1  0.761  0.793  0.196  1.0
  F  F33  1  0.761  0.207  0.304  1.0
  F  F34  1  0.739  0.207  0.696  1.0
  F  F35  1  0.739  0.793  0.804  1.0
[/CIF]
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The compound described by P2O3F4 is Indium-like structured and crystallizes in the orthorhombic Pcca space group. The structure is zero-dimensional and consists of four pyrophosphoryl tetrafluoride molecules. P(1) is bonded to one O(1), one O(2), one F(1), and one F(2) atom to form corner-sharing PO2F2 tetrahedra. There are two inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one P(1) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to two equivalent P(1) atoms. There are two inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one P(1) atom. In the second F site, F(2) is bonded in a single-bond geometry to one P(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_P2O3F4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.357
_cell_length_b   6.410
_cell_length_c   12.187
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   496.625
_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
  P  P0  1  0.121  0.310  0.899  1.0
  P  P1  1  0.121  0.690  0.601  1.0
  P  P2  1  0.379  0.690  0.399  1.0
  P  P3  1  0.379  0.310  0.101  1.0
  P  P4  1  0.879  0.690  0.101  1.0
  P  P5  1  0.879  0.310  0.399  1.0
  P  P6  1  0.621  0.310  0.601  1.0
  P  P7  1  0.621  0.690  0.899  1.0
  O  O8  1  0.080  0.530  0.888  1.0
  O  O9  1  0.080  0.470  0.612  1.0
  O  O10  1  0.420  0.470  0.388  1.0
  O  O11  1  0.420  0.530  0.112  1.0
  O  O12  1  0.920  0.470  0.112  1.0
  O  O13  1  0.920  0.530  0.388  1.0
  O  O14  1  0.580  0.530  0.612  1.0
  O  O15  1  0.580  0.470  0.888  1.0
  O  O16  1  0.250  0.229  0.000  1.0
  O  O17  1  0.250  0.771  0.500  1.0
  O  O18  1  0.750  0.771  0.000  1.0
  O  O19  1  0.750  0.229  0.500  1.0
  F  F20  1  0.929  0.167  0.906  1.0
  F  F21  1  0.929  0.833  0.594  1.0
  F  F22  1  0.571  0.833  0.406  1.0
  F  F23  1  0.571  0.167  0.094  1.0
  F  F24  1  0.071  0.833  0.094  1.0
  F  F25  1  0.071  0.167  0.406  1.0
  F  F26  1  0.429  0.167  0.594  1.0
  F  F27  1  0.429  0.833  0.906  1.0
  F  F28  1  0.239  0.207  0.804  1.0
  F  F29  1  0.239  0.793  0.696  1.0
  F  F30  1  0.261  0.793  0.304  1.0
  F  F31  1  0.261  0.207  0.196  1.0
  F  F32  1  0.761  0.793  0.196  1.0
  F  F33  1  0.761  0.207  0.304  1.0
  F  F34  1  0.739  0.207  0.696  1.0
  F  F35  1  0.739  0.793  0.804  1.0
[/CIF]
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