The crystal structure described by (MoO3)6N2 crystallizes in the hexagonal P-6 space group. The structure consists of one 7727-37-9 molecule inside a MoO3 framework. In the MoO3 framework, there are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 6-coordinate geometry to one O(3), one O(5), two equivalent O(1), and two equivalent O(6) atoms. In the second Mo site, Mo(2) is bonded in a 6-coordinate geometry to one O(4), one O(6), two equivalent O(2), and two equivalent O(5) atoms. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to two equivalent Mo(1) atoms. In the second O site, O(2) is bonded in a distorted single-bond geometry to two equivalent Mo(2) atoms. In the third O site, O(3) is bonded in a single-bond geometry to one Mo(1) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to one Mo(2) atom. In the fifth O site, O(5) is bonded in a distorted trigonal non-coplanar geometry to one Mo(1) and two equivalent Mo(2) atoms. In the sixth O site, O(6) is bonded in a distorted trigonal non-coplanar geometry to one Mo(2) and two equivalent Mo(1) atoms. is represented by the CIF file [CIF]
data_Mo3NO9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.274
_cell_length_b   11.274
_cell_length_c   3.760
_cell_angle_alpha   89.999
_cell_angle_beta   90.000
_cell_angle_gamma   120.005
_symmetry_Int_Tables_number   1
_cell_volume   413.812
_cell_formula_units_Z   2
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
  Mo  Mo0  1  0.893  0.358  0.250  1.0
  Mo  Mo1  1  0.465  0.107  0.250  1.0
  Mo  Mo2  1  0.642  0.535  0.250  1.0
  Mo  Mo3  1  0.107  0.643  0.750  1.0
  Mo  Mo4  1  0.536  0.893  0.750  1.0
  Mo  Mo5  1  0.357  0.464  0.750  1.0
  N  N6  1  0.000  0.000  0.397  1.0
  N  N7  1  0.000  0.000  0.103  1.0
  O  O8  1  0.723  0.224  0.250  1.0
  O  O9  1  0.502  0.277  0.250  1.0
  O  O10  1  0.776  0.498  0.250  1.0
  O  O11  1  0.277  0.776  0.750  1.0
  O  O12  1  0.498  0.723  0.750  1.0
  O  O13  1  0.224  0.502  0.750  1.0
  O  O14  1  0.982  0.273  0.250  1.0
  O  O15  1  0.291  0.018  0.250  1.0
  O  O16  1  0.727  0.709  0.250  1.0
  O  O17  1  0.018  0.728  0.750  1.0
  O  O18  1  0.710  0.982  0.750  1.0
  O  O19  1  0.272  0.290  0.750  1.0
  O  O20  1  0.077  0.575  0.250  1.0
  O  O21  1  0.498  0.923  0.250  1.0
  O  O22  1  0.425  0.502  0.250  1.0
  O  O23  1  0.923  0.426  0.750  1.0
  O  O24  1  0.502  0.077  0.750  1.0
  O  O25  1  0.574  0.498  0.750  1.0
[/CIF]
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The crystal structure described by (MoO3)6N2 crystallizes in the hexagonal P-6 space group. The structure consists of one 7727-37-9 molecule inside a MoO3 framework. In the MoO3 framework, there are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 6-coordinate geometry to one O(3), one O(5), two equivalent O(1), and two equivalent O(6) atoms. In the second Mo site, Mo(2) is bonded in a 6-coordinate geometry to one O(4), one O(6), two equivalent O(2), and two equivalent O(5) atoms. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to two equivalent Mo(1) atoms. In the second O site, O(2) is bonded in a distorted single-bond geometry to two equivalent Mo(2) atoms. In the third O site, O(3) is bonded in a single-bond geometry to one Mo(1) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to one Mo(2) atom. In the fifth O site, O(5) is bonded in a distorted trigonal non-coplanar geometry to one Mo(1) and two equivalent Mo(2) atoms. In the sixth O site, O(6) is bonded in a distorted trigonal non-coplanar geometry to one Mo(2) and two equivalent Mo(1) atoms. is represented by the CIF file [CIF]
data_Mo3NO9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.274
_cell_length_b   11.274
_cell_length_c   3.760
_cell_angle_alpha   89.999
_cell_angle_beta   90.000
_cell_angle_gamma   120.005
_symmetry_Int_Tables_number   1
_cell_volume   413.812
_cell_formula_units_Z   2
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
  Mo  Mo0  1  0.893  0.358  0.250  1.0
  Mo  Mo1  1  0.465  0.107  0.250  1.0
  Mo  Mo2  1  0.642  0.535  0.250  1.0
  Mo  Mo3  1  0.107  0.643  0.750  1.0
  Mo  Mo4  1  0.536  0.893  0.750  1.0
  Mo  Mo5  1  0.357  0.464  0.750  1.0
  N  N6  1  0.000  0.000  0.397  1.0
  N  N7  1  0.000  0.000  0.103  1.0
  O  O8  1  0.723  0.224  0.250  1.0
  O  O9  1  0.502  0.277  0.250  1.0
  O  O10  1  0.776  0.498  0.250  1.0
  O  O11  1  0.277  0.776  0.750  1.0
  O  O12  1  0.498  0.723  0.750  1.0
  O  O13  1  0.224  0.502  0.750  1.0
  O  O14  1  0.982  0.273  0.250  1.0
  O  O15  1  0.291  0.018  0.250  1.0
  O  O16  1  0.727  0.709  0.250  1.0
  O  O17  1  0.018  0.728  0.750  1.0
  O  O18  1  0.710  0.982  0.750  1.0
  O  O19  1  0.272  0.290  0.750  1.0
  O  O20  1  0.077  0.575  0.250  1.0
  O  O21  1  0.498  0.923  0.250  1.0
  O  O22  1  0.425  0.502  0.250  1.0
  O  O23  1  0.923  0.426  0.750  1.0
  O  O24  1  0.502  0.077  0.750  1.0
  O  O25  1  0.574  0.498  0.750  1.0
[/CIF]
.