The material described by CuZn(CN)4C4N is Cuprite-derived structured and crystallizes in the cubic F-43m space group. The structure consists of four tetramethylammonium molecules inside a CuZn(CN)4 framework. In the CuZn(CN)4 framework, Cu(1) is bonded in a tetrahedral geometry to four equivalent C(2) atoms. Zn(1) is bonded in a tetrahedral geometry to four equivalent N(2) atoms. C(2) is bonded in a linear geometry to one Cu(1) and one N(2) atom. N(2) is bonded in a linear geometry to one Zn(1) and one C(2) atom. is represented by the CIF file [CIF]
data_ZnCuC8N5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.280
_cell_length_b   8.280
_cell_length_c   8.280
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   401.379
_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
  Zn  Zn0  1  0.750  0.750  0.750  1.0
  Cu  Cu1  1  0.000  0.000  0.000  1.0
  C  C2  1  0.428  0.428  0.428  1.0
  C  C3  1  0.428  0.717  0.428  1.0
  C  C4  1  0.717  0.428  0.428  1.0
  C  C5  1  0.428  0.428  0.717  1.0
  C  C6  1  0.904  0.904  0.904  1.0
  C  C7  1  0.904  0.287  0.904  1.0
  C  C8  1  0.287  0.904  0.904  1.0
  C  C9  1  0.904  0.904  0.287  1.0
  N  N10  1  0.500  0.500  0.500  1.0
  N  N11  1  0.847  0.847  0.847  1.0
  N  N12  1  0.847  0.460  0.847  1.0
  N  N13  1  0.460  0.847  0.847  1.0
  N  N14  1  0.847  0.847  0.460  1.0
[/CIF]
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The material described by CuZn(CN)4C4N is Cuprite-derived structured and crystallizes in the cubic F-43m space group. The structure consists of four tetramethylammonium molecules inside a CuZn(CN)4 framework. In the CuZn(CN)4 framework, Cu(1) is bonded in a tetrahedral geometry to four equivalent C(2) atoms. Zn(1) is bonded in a tetrahedral geometry to four equivalent N(2) atoms. C(2) is bonded in a linear geometry to one Cu(1) and one N(2) atom. N(2) is bonded in a linear geometry to one Zn(1) and one C(2) atom. is represented by the CIF file [CIF]
data_ZnCuC8N5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.280
_cell_length_b   8.280
_cell_length_c   8.280
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   401.379
_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
  Zn  Zn0  1  0.750  0.750  0.750  1.0
  Cu  Cu1  1  0.000  0.000  0.000  1.0
  C  C2  1  0.428  0.428  0.428  1.0
  C  C3  1  0.428  0.717  0.428  1.0
  C  C4  1  0.717  0.428  0.428  1.0
  C  C5  1  0.428  0.428  0.717  1.0
  C  C6  1  0.904  0.904  0.904  1.0
  C  C7  1  0.904  0.287  0.904  1.0
  C  C8  1  0.287  0.904  0.904  1.0
  C  C9  1  0.904  0.904  0.287  1.0
  N  N10  1  0.500  0.500  0.500  1.0
  N  N11  1  0.847  0.847  0.847  1.0
  N  N12  1  0.847  0.460  0.847  1.0
  N  N13  1  0.460  0.847  0.847  1.0
  N  N14  1  0.847  0.847  0.460  1.0
[/CIF]
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