The compound described by (CNCl)3C3N3Cl3F2(AsF6)2 is Indium-derived structured and crystallizes in the monoclinic C2 space group. The structure is zero-dimensional and consists of two 2,4,6-trichloro-1,3,5-triazin-1-ium molecules; four AsF6 clusters; and two C3N3Cl3F2 clusters. In each AsF6 cluster, As(1) is bonded in an octahedral geometry to one F(1), one F(2), one F(3), one F(4), one F(5), and one F(6) atom. There are six inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one As(1) atom. In the second F site, F(2) is bonded in a single-bond geometry to one As(1) atom. In the third F site, F(3) is bonded in a single-bond geometry to one As(1) atom. In the fourth F site, F(4) is bonded in a single-bond geometry to one As(1) atom. In the fifth F site, F(5) is bonded in a single-bond geometry to one As(1) atom. In the sixth F site, F(6) is bonded in a single-bond geometry to one As(1) atom. In each C3N3Cl3F2 cluster, there are two inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one N(1), one N(2), and one Cl(1) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to two equivalent N(1) and one Cl(2) atom. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one C(1), one C(2), and one F(7) atom. In the second N site, N(2) is bonded in a bent 120 degrees geometry to two equivalent C(1) atoms. There are two inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one C(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one C(2) atom. F(7) is bonded in a single-bond geometry to one N(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_AsC3N3Cl3F7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.207
_cell_length_b   8.207
_cell_length_c   8.211
_cell_angle_alpha   82.318
_cell_angle_beta   82.318
_cell_angle_gamma   81.888
_symmetry_Int_Tables_number   1
_cell_volume   538.844
_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
  As  As0  1  0.499  0.999  0.249  1.0
  As  As1  1  0.001  0.501  0.751  1.0
  C  C2  1  0.258  0.618  0.123  1.0
  C  C3  1  0.382  0.742  0.877  1.0
  C  C4  1  0.122  0.878  0.000  1.0
  C  C5  1  0.748  0.369  0.379  1.0
  C  C6  1  0.631  0.252  0.621  1.0
  C  C7  1  0.869  0.131  0.500  1.0
  N  N8  1  0.252  0.869  0.879  1.0
  N  N9  1  0.131  0.748  0.121  1.0
  N  N10  1  0.379  0.621  0.000  1.0
  N  N11  1  0.750  0.123  0.628  1.0
  N  N12  1  0.877  0.250  0.372  1.0
  N  N13  1  0.621  0.379  0.500  1.0
  Cl  Cl14  1  0.252  0.470  0.278  1.0
  Cl  Cl15  1  0.530  0.748  0.722  1.0
  Cl  Cl16  1  0.971  0.029  0.000  1.0
  Cl  Cl17  1  0.741  0.524  0.218  1.0
  Cl  Cl18  1  0.476  0.259  0.782  1.0
  Cl  Cl19  1  0.028  0.972  0.500  1.0
  F  F20  1  0.673  0.913  0.352  1.0
  F  F21  1  0.601  0.172  0.163  1.0
  F  F22  1  0.413  0.103  0.422  1.0
  F  F23  1  0.176  0.605  0.669  1.0
  F  F24  1  0.919  0.678  0.855  1.0
  F  F25  1  0.104  0.417  0.927  1.0
  F  F26  1  0.322  0.081  0.145  1.0
  F  F27  1  0.395  0.824  0.331  1.0
  F  F28  1  0.583  0.896  0.073  1.0
  F  F29  1  0.828  0.399  0.837  1.0
  F  F30  1  0.087  0.327  0.648  1.0
  F  F31  1  0.897  0.587  0.578  1.0
  F  F32  1  0.250  0.997  0.755  1.0
  F  F33  1  0.003  0.750  0.245  1.0
[/CIF]
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The compound described by (CNCl)3C3N3Cl3F2(AsF6)2 is Indium-derived structured and crystallizes in the monoclinic C2 space group. The structure is zero-dimensional and consists of two 2,4,6-trichloro-1,3,5-triazin-1-ium molecules; four AsF6 clusters; and two C3N3Cl3F2 clusters. In each AsF6 cluster, As(1) is bonded in an octahedral geometry to one F(1), one F(2), one F(3), one F(4), one F(5), and one F(6) atom. There are six inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one As(1) atom. In the second F site, F(2) is bonded in a single-bond geometry to one As(1) atom. In the third F site, F(3) is bonded in a single-bond geometry to one As(1) atom. In the fourth F site, F(4) is bonded in a single-bond geometry to one As(1) atom. In the fifth F site, F(5) is bonded in a single-bond geometry to one As(1) atom. In the sixth F site, F(6) is bonded in a single-bond geometry to one As(1) atom. In each C3N3Cl3F2 cluster, there are two inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one N(1), one N(2), and one Cl(1) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to two equivalent N(1) and one Cl(2) atom. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one C(1), one C(2), and one F(7) atom. In the second N site, N(2) is bonded in a bent 120 degrees geometry to two equivalent C(1) atoms. There are two inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one C(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one C(2) atom. F(7) is bonded in a single-bond geometry to one N(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_AsC3N3Cl3F7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.207
_cell_length_b   8.207
_cell_length_c   8.211
_cell_angle_alpha   82.318
_cell_angle_beta   82.318
_cell_angle_gamma   81.888
_symmetry_Int_Tables_number   1
_cell_volume   538.844
_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
  As  As0  1  0.499  0.999  0.249  1.0
  As  As1  1  0.001  0.501  0.751  1.0
  C  C2  1  0.258  0.618  0.123  1.0
  C  C3  1  0.382  0.742  0.877  1.0
  C  C4  1  0.122  0.878  0.000  1.0
  C  C5  1  0.748  0.369  0.379  1.0
  C  C6  1  0.631  0.252  0.621  1.0
  C  C7  1  0.869  0.131  0.500  1.0
  N  N8  1  0.252  0.869  0.879  1.0
  N  N9  1  0.131  0.748  0.121  1.0
  N  N10  1  0.379  0.621  0.000  1.0
  N  N11  1  0.750  0.123  0.628  1.0
  N  N12  1  0.877  0.250  0.372  1.0
  N  N13  1  0.621  0.379  0.500  1.0
  Cl  Cl14  1  0.252  0.470  0.278  1.0
  Cl  Cl15  1  0.530  0.748  0.722  1.0
  Cl  Cl16  1  0.971  0.029  0.000  1.0
  Cl  Cl17  1  0.741  0.524  0.218  1.0
  Cl  Cl18  1  0.476  0.259  0.782  1.0
  Cl  Cl19  1  0.028  0.972  0.500  1.0
  F  F20  1  0.673  0.913  0.352  1.0
  F  F21  1  0.601  0.172  0.163  1.0
  F  F22  1  0.413  0.103  0.422  1.0
  F  F23  1  0.176  0.605  0.669  1.0
  F  F24  1  0.919  0.678  0.855  1.0
  F  F25  1  0.104  0.417  0.927  1.0
  F  F26  1  0.322  0.081  0.145  1.0
  F  F27  1  0.395  0.824  0.331  1.0
  F  F28  1  0.583  0.896  0.073  1.0
  F  F29  1  0.828  0.399  0.837  1.0
  F  F30  1  0.087  0.327  0.648  1.0
  F  F31  1  0.897  0.587  0.578  1.0
  F  F32  1  0.250  0.997  0.755  1.0
  F  F33  1  0.003  0.750  0.245  1.0
[/CIF]
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