The material structure described by VOCl3 is Silicon tetrafluoride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four trichlorovanadium;hydrate molecules. V(1) is bonded in a tetrahedral geometry to one O(1), one Cl(1), and two equivalent Cl(2) atoms. O(1) is bonded in a single-bond geometry to one V(1) atom. There are two inequivalent Cl sites. In the first Cl site, Cl(2) is bonded in a single-bond geometry to one V(1) atom. In the second Cl site, Cl(1) is bonded in a single-bond geometry to one V(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_VCl3O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.964
_cell_length_b   9.377
_cell_length_c   11.533
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   536.823
_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
  V  V0  1  0.358  0.750  0.546  1.0
  V  V1  1  0.858  0.750  0.954  1.0
  V  V2  1  0.642  0.250  0.454  1.0
  V  V3  1  0.142  0.250  0.046  1.0
  Cl  Cl4  1  0.242  0.750  0.367  1.0
  Cl  Cl5  1  0.758  0.250  0.633  1.0
  Cl  Cl6  1  0.742  0.750  0.133  1.0
  Cl  Cl7  1  0.258  0.250  0.867  1.0
  Cl  Cl8  1  0.277  0.061  0.131  1.0
  Cl  Cl9  1  0.777  0.439  0.369  1.0
  Cl  Cl10  1  0.777  0.061  0.369  1.0
  Cl  Cl11  1  0.223  0.939  0.631  1.0
  Cl  Cl12  1  0.723  0.939  0.869  1.0
  Cl  Cl13  1  0.223  0.561  0.631  1.0
  Cl  Cl14  1  0.277  0.439  0.131  1.0
  Cl  Cl15  1  0.723  0.561  0.869  1.0
  O  O16  1  0.677  0.750  0.551  1.0
  O  O17  1  0.177  0.750  0.949  1.0
  O  O18  1  0.323  0.250  0.449  1.0
  O  O19  1  0.823  0.250  0.051  1.0
[/CIF]
.
The material structure described by VOCl3 is Silicon tetrafluoride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four trichlorovanadium;hydrate molecules. V(1) is bonded in a tetrahedral geometry to one O(1), one Cl(1), and two equivalent Cl(2) atoms. O(1) is bonded in a single-bond geometry to one V(1) atom. There are two inequivalent Cl sites. In the first Cl site, Cl(2) is bonded in a single-bond geometry to one V(1) atom. In the second Cl site, Cl(1) is bonded in a single-bond geometry to one V(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_VCl3O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.964
_cell_length_b   9.377
_cell_length_c   11.533
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   536.823
_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
  V  V0  1  0.358  0.750  0.546  1.0
  V  V1  1  0.858  0.750  0.954  1.0
  V  V2  1  0.642  0.250  0.454  1.0
  V  V3  1  0.142  0.250  0.046  1.0
  Cl  Cl4  1  0.242  0.750  0.367  1.0
  Cl  Cl5  1  0.758  0.250  0.633  1.0
  Cl  Cl6  1  0.742  0.750  0.133  1.0
  Cl  Cl7  1  0.258  0.250  0.867  1.0
  Cl  Cl8  1  0.277  0.061  0.131  1.0
  Cl  Cl9  1  0.777  0.439  0.369  1.0
  Cl  Cl10  1  0.777  0.061  0.369  1.0
  Cl  Cl11  1  0.223  0.939  0.631  1.0
  Cl  Cl12  1  0.723  0.939  0.869  1.0
  Cl  Cl13  1  0.223  0.561  0.631  1.0
  Cl  Cl14  1  0.277  0.439  0.131  1.0
  Cl  Cl15  1  0.723  0.561  0.869  1.0
  O  O16  1  0.677  0.750  0.551  1.0
  O  O17  1  0.177  0.750  0.949  1.0
  O  O18  1  0.323  0.250  0.449  1.0
  O  O19  1  0.823  0.250  0.051  1.0
[/CIF]
.