The compound described by NaGaCl4 crystallizes in the orthorhombic P2_12_12_1 space group. Na(1) is bonded in a 7-coordinate geometry to one Cl(2), two equivalent Cl(1), two equivalent Cl(3), and two equivalent Cl(4) atoms. Ga(1) is bonded in a tetrahedral geometry to one Cl(1), one Cl(2), one Cl(3), and one Cl(4) atom. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a 3-coordinate geometry to two equivalent Na(1) and one Ga(1) atom. In the second Cl site, Cl(2) is bonded in a bent 120 degrees geometry to one Na(1) and one Ga(1) atom. In the third Cl site, Cl(3) is bonded in a distorted trigonal planar geometry to two equivalent Na(1) and one Ga(1) atom. In the fourth Cl site, Cl(4) is bonded in a 3-coordinate geometry to two equivalent Na(1) and one Ga(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaGaCl4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.176
_cell_length_b   9.803
_cell_length_c   10.262
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   621.336
_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
  Na  Na0  1  0.937  0.963  0.372  1.0
  Na  Na1  1  0.563  0.037  0.872  1.0
  Na  Na2  1  0.437  0.537  0.628  1.0
  Na  Na3  1  0.063  0.463  0.128  1.0
  Ga  Ga4  1  0.037  0.764  0.787  1.0
  Ga  Ga5  1  0.463  0.236  0.287  1.0
  Ga  Ga6  1  0.537  0.736  0.213  1.0
  Ga  Ga7  1  0.963  0.264  0.713  1.0
  Cl  Cl8  1  0.175  0.771  0.591  1.0
  Cl  Cl9  1  0.325  0.229  0.091  1.0
  Cl  Cl10  1  0.675  0.729  0.409  1.0
  Cl  Cl11  1  0.825  0.271  0.909  1.0
  Cl  Cl12  1  0.140  0.941  0.901  1.0
  Cl  Cl13  1  0.360  0.059  0.401  1.0
  Cl  Cl14  1  0.640  0.559  0.099  1.0
  Cl  Cl15  1  0.860  0.441  0.599  1.0
  Cl  Cl16  1  0.683  0.759  0.784  1.0
  Cl  Cl17  1  0.817  0.241  0.284  1.0
  Cl  Cl18  1  0.183  0.741  0.216  1.0
  Cl  Cl19  1  0.317  0.259  0.716  1.0
  Cl  Cl20  1  0.176  0.579  0.874  1.0
  Cl  Cl21  1  0.324  0.421  0.374  1.0
  Cl  Cl22  1  0.676  0.921  0.126  1.0
  Cl  Cl23  1  0.824  0.079  0.626  1.0
[/CIF]
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The compound described by NaGaCl4 crystallizes in the orthorhombic P2_12_12_1 space group. Na(1) is bonded in a 7-coordinate geometry to one Cl(2), two equivalent Cl(1), two equivalent Cl(3), and two equivalent Cl(4) atoms. Ga(1) is bonded in a tetrahedral geometry to one Cl(1), one Cl(2), one Cl(3), and one Cl(4) atom. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a 3-coordinate geometry to two equivalent Na(1) and one Ga(1) atom. In the second Cl site, Cl(2) is bonded in a bent 120 degrees geometry to one Na(1) and one Ga(1) atom. In the third Cl site, Cl(3) is bonded in a distorted trigonal planar geometry to two equivalent Na(1) and one Ga(1) atom. In the fourth Cl site, Cl(4) is bonded in a 3-coordinate geometry to two equivalent Na(1) and one Ga(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaGaCl4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.176
_cell_length_b   9.803
_cell_length_c   10.262
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   621.336
_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
  Na  Na0  1  0.937  0.963  0.372  1.0
  Na  Na1  1  0.563  0.037  0.872  1.0
  Na  Na2  1  0.437  0.537  0.628  1.0
  Na  Na3  1  0.063  0.463  0.128  1.0
  Ga  Ga4  1  0.037  0.764  0.787  1.0
  Ga  Ga5  1  0.463  0.236  0.287  1.0
  Ga  Ga6  1  0.537  0.736  0.213  1.0
  Ga  Ga7  1  0.963  0.264  0.713  1.0
  Cl  Cl8  1  0.175  0.771  0.591  1.0
  Cl  Cl9  1  0.325  0.229  0.091  1.0
  Cl  Cl10  1  0.675  0.729  0.409  1.0
  Cl  Cl11  1  0.825  0.271  0.909  1.0
  Cl  Cl12  1  0.140  0.941  0.901  1.0
  Cl  Cl13  1  0.360  0.059  0.401  1.0
  Cl  Cl14  1  0.640  0.559  0.099  1.0
  Cl  Cl15  1  0.860  0.441  0.599  1.0
  Cl  Cl16  1  0.683  0.759  0.784  1.0
  Cl  Cl17  1  0.817  0.241  0.284  1.0
  Cl  Cl18  1  0.183  0.741  0.216  1.0
  Cl  Cl19  1  0.317  0.259  0.716  1.0
  Cl  Cl20  1  0.176  0.579  0.874  1.0
  Cl  Cl21  1  0.324  0.421  0.374  1.0
  Cl  Cl22  1  0.676  0.921  0.126  1.0
  Cl  Cl23  1  0.824  0.079  0.626  1.0
[/CIF]
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