The compound described by CN2CTeSe2(NBr)2 is Indium-derived structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two cyanamide molecules and two CTeSe2(NBr)2 clusters. In each CTeSe2(NBr)2 cluster, C(2) is bonded in a linear geometry to one N(3) and one N(4) atom. There are two inequivalent N sites. In the first N site, N(3) is bonded in a single-bond geometry to one C(2) atom. In the second N site, N(4) is bonded in a bent 120 degrees geometry to one C(2) and one Se(2) atom. Te(1) is bonded in a 3-coordinate geometry to one Se(1), one Se(2), and one Br(1) atom. There are two inequivalent Se sites. In the first Se site, Se(1) is bonded in a distorted bent 120 degrees geometry to one Te(1) and one Br(2) atom. In the second Se site, Se(2) is bonded in a distorted single-bond geometry to one N(4) and one Te(1) atom. There are two inequivalent Br sites. In the first Br site, Br(1) is bonded in a single-bond geometry to one Te(1) atom. In the second Br site, Br(2) is bonded in a single-bond geometry to one Se(1) atom. is represented by the CIF file [CIF]
data_TeC2Se2(BrN2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.278
_cell_length_b   7.354
_cell_length_c   11.301
_cell_angle_alpha   105.059
_cell_angle_beta   91.424
_cell_angle_gamma   91.145
_symmetry_Int_Tables_number   1
_cell_volume   583.683
_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
  Te  Te0  1  0.171  0.082  0.109  1.0
  Te  Te1  1  0.829  0.918  0.891  1.0
  C  C2  1  0.687  0.815  0.182  1.0
  C  C3  1  0.313  0.185  0.818  1.0
  C  C4  1  0.317  0.550  0.330  1.0
  C  C5  1  0.683  0.450  0.670  1.0
  Se  Se6  1  0.063  0.063  0.321  1.0
  Se  Se7  1  0.937  0.937  0.679  1.0
  Se  Se8  1  0.983  0.385  0.256  1.0
  Se  Se9  1  0.017  0.615  0.744  1.0
  Br  Br10  1  0.309  0.752  0.988  1.0
  Br  Br11  1  0.691  0.248  0.012  1.0
  Br  Br12  1  0.273  0.204  0.483  1.0
  Br  Br13  1  0.727  0.796  0.517  1.0
  N  N14  1  0.818  0.741  0.122  1.0
  N  N15  1  0.182  0.259  0.878  1.0
  N  N16  1  0.558  0.895  0.243  1.0
  N  N17  1  0.442  0.105  0.757  1.0
  N  N18  1  0.480  0.555  0.326  1.0
  N  N19  1  0.520  0.445  0.674  1.0
  N  N20  1  0.140  0.558  0.346  1.0
  N  N21  1  0.860  0.442  0.654  1.0
[/CIF]
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The compound described by CN2CTeSe2(NBr)2 is Indium-derived structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two cyanamide molecules and two CTeSe2(NBr)2 clusters. In each CTeSe2(NBr)2 cluster, C(2) is bonded in a linear geometry to one N(3) and one N(4) atom. There are two inequivalent N sites. In the first N site, N(3) is bonded in a single-bond geometry to one C(2) atom. In the second N site, N(4) is bonded in a bent 120 degrees geometry to one C(2) and one Se(2) atom. Te(1) is bonded in a 3-coordinate geometry to one Se(1), one Se(2), and one Br(1) atom. There are two inequivalent Se sites. In the first Se site, Se(1) is bonded in a distorted bent 120 degrees geometry to one Te(1) and one Br(2) atom. In the second Se site, Se(2) is bonded in a distorted single-bond geometry to one N(4) and one Te(1) atom. There are two inequivalent Br sites. In the first Br site, Br(1) is bonded in a single-bond geometry to one Te(1) atom. In the second Br site, Br(2) is bonded in a single-bond geometry to one Se(1) atom. is represented by the CIF file [CIF]
data_TeC2Se2(BrN2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.278
_cell_length_b   7.354
_cell_length_c   11.301
_cell_angle_alpha   105.059
_cell_angle_beta   91.424
_cell_angle_gamma   91.145
_symmetry_Int_Tables_number   1
_cell_volume   583.683
_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
  Te  Te0  1  0.171  0.082  0.109  1.0
  Te  Te1  1  0.829  0.918  0.891  1.0
  C  C2  1  0.687  0.815  0.182  1.0
  C  C3  1  0.313  0.185  0.818  1.0
  C  C4  1  0.317  0.550  0.330  1.0
  C  C5  1  0.683  0.450  0.670  1.0
  Se  Se6  1  0.063  0.063  0.321  1.0
  Se  Se7  1  0.937  0.937  0.679  1.0
  Se  Se8  1  0.983  0.385  0.256  1.0
  Se  Se9  1  0.017  0.615  0.744  1.0
  Br  Br10  1  0.309  0.752  0.988  1.0
  Br  Br11  1  0.691  0.248  0.012  1.0
  Br  Br12  1  0.273  0.204  0.483  1.0
  Br  Br13  1  0.727  0.796  0.517  1.0
  N  N14  1  0.818  0.741  0.122  1.0
  N  N15  1  0.182  0.259  0.878  1.0
  N  N16  1  0.558  0.895  0.243  1.0
  N  N17  1  0.442  0.105  0.757  1.0
  N  N18  1  0.480  0.555  0.326  1.0
  N  N19  1  0.520  0.445  0.674  1.0
  N  N20  1  0.140  0.558  0.346  1.0
  N  N21  1  0.860  0.442  0.654  1.0
[/CIF]
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