The compound described by Mg(MoO2)4 is Hydrophilite-derived structured and crystallizes in the triclinic P1 space group. The structure consists of one 7439-95-4 atom inside a MoO2 framework. In the MoO2 framework, there are four inequivalent Mo sites. In the first Mo site, Mo(1) is bonded to one O(2), one O(7), two equivalent O(4), and two equivalent O(5) atoms to form a mixture of edge and corner-sharing MoO6 octahedra. The corner-sharing octahedral tilt angles range from 49-53°. In the second Mo site, Mo(2) is bonded to one O(4), one O(8), two equivalent O(3), and two equivalent O(6) atoms to form a mixture of edge and corner-sharing MoO6 octahedra. The corner-sharing octahedral tilt angles range from 50-53°. In the third Mo site, Mo(3) is bonded to one O(1), one O(6), two equivalent O(2), and two equivalent O(8) atoms to form a mixture of edge and corner-sharing MoO6 octahedra. The corner-sharing octahedral tilt angles range from 49-53°. In the fourth Mo site, Mo(4) is bonded to one O(3), one O(5), two equivalent O(1), and two equivalent O(7) atoms to form a mixture of edge and corner-sharing MoO6 octahedra. The corner-sharing octahedral tilt angles range from 49-52°. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one Mo(3) and two equivalent Mo(4) atoms. In the second O site, O(2) is bonded in a trigonal planar geometry to one Mo(1) and two equivalent Mo(3) atoms. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Mo(4) and two equivalent Mo(2) atoms. In the fourth O site, O(4) is bonded in a trigonal planar geometry to one Mo(2) and two equivalent Mo(1) atoms. In the fifth O site, O(5) is bonded in a distorted trigonal non-coplanar geometry to one Mo(4) and two equivalent Mo(1) atoms. In the sixth O site, O(6) is bonded in a distorted trigonal non-coplanar geometry to one Mo(3) and two equivalent Mo(2) atoms. In the seventh O site, O(7) is bonded in a distorted trigonal non-coplanar geometry to one Mo(1) and two equivalent Mo(4) atoms. In the eighth O site, O(8) is bonded in a distorted T-shaped geometry to one Mo(2) and two equivalent Mo(3) atoms. is represented by the CIF file [CIF]
data_Mg(MoO2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.232
_cell_length_b   7.567
_cell_length_c   7.831
_cell_angle_alpha   87.760
_cell_angle_beta   77.430
_cell_angle_gamma   76.457
_symmetry_Int_Tables_number   1
_cell_volume   181.723
_cell_formula_units_Z   1
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
  Mg  Mg0  1  0.502  0.001  0.997  1.0
  Mo  Mo1  1  0.629  0.186  0.513  1.0
  Mo  Mo2  1  0.178  0.486  0.181  1.0
  Mo  Mo3  1  0.841  0.517  0.819  1.0
  Mo  Mo4  1  0.346  0.810  0.486  1.0
  O  O5  1  0.830  0.701  0.624  1.0
  O  O6  1  0.458  0.376  0.709  1.0
  O  O7  1  0.541  0.621  0.302  1.0
  O  O8  1  0.168  0.295  0.385  1.0
  O  O9  1  0.133  0.048  0.638  1.0
  O  O10  1  0.827  0.355  0.037  1.0
  O  O11  1  0.838  0.950  0.362  1.0
  O  O12  1  0.210  0.654  0.947  1.0
[/CIF]
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The compound described by Mg(MoO2)4 is Hydrophilite-derived structured and crystallizes in the triclinic P1 space group. The structure consists of one 7439-95-4 atom inside a MoO2 framework. In the MoO2 framework, there are four inequivalent Mo sites. In the first Mo site, Mo(1) is bonded to one O(2), one O(7), two equivalent O(4), and two equivalent O(5) atoms to form a mixture of edge and corner-sharing MoO6 octahedra. The corner-sharing octahedral tilt angles range from 49-53°. In the second Mo site, Mo(2) is bonded to one O(4), one O(8), two equivalent O(3), and two equivalent O(6) atoms to form a mixture of edge and corner-sharing MoO6 octahedra. The corner-sharing octahedral tilt angles range from 50-53°. In the third Mo site, Mo(3) is bonded to one O(1), one O(6), two equivalent O(2), and two equivalent O(8) atoms to form a mixture of edge and corner-sharing MoO6 octahedra. The corner-sharing octahedral tilt angles range from 49-53°. In the fourth Mo site, Mo(4) is bonded to one O(3), one O(5), two equivalent O(1), and two equivalent O(7) atoms to form a mixture of edge and corner-sharing MoO6 octahedra. The corner-sharing octahedral tilt angles range from 49-52°. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one Mo(3) and two equivalent Mo(4) atoms. In the second O site, O(2) is bonded in a trigonal planar geometry to one Mo(1) and two equivalent Mo(3) atoms. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Mo(4) and two equivalent Mo(2) atoms. In the fourth O site, O(4) is bonded in a trigonal planar geometry to one Mo(2) and two equivalent Mo(1) atoms. In the fifth O site, O(5) is bonded in a distorted trigonal non-coplanar geometry to one Mo(4) and two equivalent Mo(1) atoms. In the sixth O site, O(6) is bonded in a distorted trigonal non-coplanar geometry to one Mo(3) and two equivalent Mo(2) atoms. In the seventh O site, O(7) is bonded in a distorted trigonal non-coplanar geometry to one Mo(1) and two equivalent Mo(4) atoms. In the eighth O site, O(8) is bonded in a distorted T-shaped geometry to one Mo(2) and two equivalent Mo(3) atoms. is represented by the CIF file [CIF]
data_Mg(MoO2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.232
_cell_length_b   7.567
_cell_length_c   7.831
_cell_angle_alpha   87.760
_cell_angle_beta   77.430
_cell_angle_gamma   76.457
_symmetry_Int_Tables_number   1
_cell_volume   181.723
_cell_formula_units_Z   1
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
  Mg  Mg0  1  0.502  0.001  0.997  1.0
  Mo  Mo1  1  0.629  0.186  0.513  1.0
  Mo  Mo2  1  0.178  0.486  0.181  1.0
  Mo  Mo3  1  0.841  0.517  0.819  1.0
  Mo  Mo4  1  0.346  0.810  0.486  1.0
  O  O5  1  0.830  0.701  0.624  1.0
  O  O6  1  0.458  0.376  0.709  1.0
  O  O7  1  0.541  0.621  0.302  1.0
  O  O8  1  0.168  0.295  0.385  1.0
  O  O9  1  0.133  0.048  0.638  1.0
  O  O10  1  0.827  0.355  0.037  1.0
  O  O11  1  0.838  0.950  0.362  1.0
  O  O12  1  0.210  0.654  0.947  1.0
[/CIF]
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