The structure described by HgBr2HgC4NBr3C4NBr is Cyanogen Chloride-derived structured and crystallizes in the monoclinic P2_1 space group. The structure is zero-dimensional and consists of two mercuric bromide molecules, two C4NBr clusters, and two HgC4NBr3 clusters. In each C4NBr cluster, there are four inequivalent C sites. In the first C site, C(5) is bonded in a distorted bent 150 degrees geometry to one C(7) and one N(2) atom. In the second C site, C(6) is bonded in a single-bond geometry to one N(2) atom. In the third C site, C(7) is bonded in a linear geometry to one C(5) and one C(8) atom. In the fourth C site, C(8) is bonded in a distorted linear geometry to one C(7) and one Br(2) atom. N(2) is bonded in a linear geometry to one C(5) and one C(6) atom. Br(2) is bonded in a single-bond geometry to one C(8) atom. In each HgC4NBr3 cluster, Hg(2) is bonded in a distorted T-shaped geometry to one N(1), one Br(4), and one Br(6) atom. There are four inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one C(2) and one C(4) atom. In the second C site, C(2) is bonded in a distorted linear geometry to one C(1) and one Br(5) atom. In the third C site, C(3) is bonded in a distorted linear geometry to one C(4) and one N(1) atom. In the fourth C site, C(4) is bonded in a linear geometry to one C(1) and one C(3) atom. N(1) is bonded in a distorted single-bond geometry to one Hg(2) and one C(3) atom. There are three inequivalent Br sites. In the first Br site, Br(4) is bonded in a single-bond geometry to one Hg(2) atom. In the second Br site, Br(5) is bonded in a single-bond geometry to one C(2) atom. In the third Br site, Br(6) is bonded in a single-bond geometry to one Hg(2) atom. is represented by the CIF card [CIF]
data_HgC4Br3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.992
_cell_length_b   8.430
_cell_length_c   8.666
_cell_angle_alpha   86.891
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1385.526
_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
  Hg  Hg0  1  0.464  0.259  0.937  1.0
  Hg  Hg1  1  0.964  0.741  0.063  1.0
  Hg  Hg2  1  0.479  0.179  0.445  1.0
  Hg  Hg3  1  0.979  0.821  0.555  1.0
  C  C4  1  0.698  0.654  0.530  1.0
  C  C5  1  0.198  0.346  0.470  1.0
  C  C6  1  0.755  0.578  0.529  1.0
  C  C7  1  0.255  0.422  0.471  1.0
  C  C8  1  0.579  0.809  0.529  1.0
  C  C9  1  0.079  0.191  0.471  1.0
  C  C10  1  0.640  0.734  0.532  1.0
  C  C11  1  0.140  0.266  0.468  1.0
  C  C12  1  0.297  0.680  0.939  1.0
  C  C13  1  0.797  0.320  0.061  1.0
  C  C14  1  0.425  0.630  0.900  1.0
  C  C15  1  0.925  0.370  0.100  1.0
  C  C16  1  0.245  0.776  0.960  1.0
  C  C17  1  0.745  0.224  0.040  1.0
  C  C18  1  0.194  0.865  0.983  1.0
  C  C19  1  0.694  0.135  0.017  1.0
  Br  Br20  1  0.548  0.381  0.110  1.0
  Br  Br21  1  0.048  0.619  0.890  1.0
  Br  Br22  1  0.633  0.977  0.999  1.0
  Br  Br23  1  0.133  0.023  0.001  1.0
  Br  Br24  1  0.381  0.125  0.770  1.0
  Br  Br25  1  0.881  0.875  0.230  1.0
  Br  Br26  1  0.574  0.292  0.599  1.0
  Br  Br27  1  0.074  0.708  0.401  1.0
  Br  Br28  1  0.326  0.557  0.472  1.0
  Br  Br29  1  0.826  0.443  0.528  1.0
  Br  Br30  1  0.381  0.112  0.271  1.0
  Br  Br31  1  0.881  0.888  0.729  1.0
  N  N32  1  0.523  0.876  0.526  1.0
  N  N33  1  0.023  0.124  0.474  1.0
  N  N34  1  0.363  0.655  0.921  1.0
  N  N35  1  0.863  0.345  0.079  1.0
[/CIF]
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The structure described by HgBr2HgC4NBr3C4NBr is Cyanogen Chloride-derived structured and crystallizes in the monoclinic P2_1 space group. The structure is zero-dimensional and consists of two mercuric bromide molecules, two C4NBr clusters, and two HgC4NBr3 clusters. In each C4NBr cluster, there are four inequivalent C sites. In the first C site, C(5) is bonded in a distorted bent 150 degrees geometry to one C(7) and one N(2) atom. In the second C site, C(6) is bonded in a single-bond geometry to one N(2) atom. In the third C site, C(7) is bonded in a linear geometry to one C(5) and one C(8) atom. In the fourth C site, C(8) is bonded in a distorted linear geometry to one C(7) and one Br(2) atom. N(2) is bonded in a linear geometry to one C(5) and one C(6) atom. Br(2) is bonded in a single-bond geometry to one C(8) atom. In each HgC4NBr3 cluster, Hg(2) is bonded in a distorted T-shaped geometry to one N(1), one Br(4), and one Br(6) atom. There are four inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one C(2) and one C(4) atom. In the second C site, C(2) is bonded in a distorted linear geometry to one C(1) and one Br(5) atom. In the third C site, C(3) is bonded in a distorted linear geometry to one C(4) and one N(1) atom. In the fourth C site, C(4) is bonded in a linear geometry to one C(1) and one C(3) atom. N(1) is bonded in a distorted single-bond geometry to one Hg(2) and one C(3) atom. There are three inequivalent Br sites. In the first Br site, Br(4) is bonded in a single-bond geometry to one Hg(2) atom. In the second Br site, Br(5) is bonded in a single-bond geometry to one C(2) atom. In the third Br site, Br(6) is bonded in a single-bond geometry to one Hg(2) atom. is represented by the CIF card [CIF]
data_HgC4Br3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.992
_cell_length_b   8.430
_cell_length_c   8.666
_cell_angle_alpha   86.891
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1385.526
_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
  Hg  Hg0  1  0.464  0.259  0.937  1.0
  Hg  Hg1  1  0.964  0.741  0.063  1.0
  Hg  Hg2  1  0.479  0.179  0.445  1.0
  Hg  Hg3  1  0.979  0.821  0.555  1.0
  C  C4  1  0.698  0.654  0.530  1.0
  C  C5  1  0.198  0.346  0.470  1.0
  C  C6  1  0.755  0.578  0.529  1.0
  C  C7  1  0.255  0.422  0.471  1.0
  C  C8  1  0.579  0.809  0.529  1.0
  C  C9  1  0.079  0.191  0.471  1.0
  C  C10  1  0.640  0.734  0.532  1.0
  C  C11  1  0.140  0.266  0.468  1.0
  C  C12  1  0.297  0.680  0.939  1.0
  C  C13  1  0.797  0.320  0.061  1.0
  C  C14  1  0.425  0.630  0.900  1.0
  C  C15  1  0.925  0.370  0.100  1.0
  C  C16  1  0.245  0.776  0.960  1.0
  C  C17  1  0.745  0.224  0.040  1.0
  C  C18  1  0.194  0.865  0.983  1.0
  C  C19  1  0.694  0.135  0.017  1.0
  Br  Br20  1  0.548  0.381  0.110  1.0
  Br  Br21  1  0.048  0.619  0.890  1.0
  Br  Br22  1  0.633  0.977  0.999  1.0
  Br  Br23  1  0.133  0.023  0.001  1.0
  Br  Br24  1  0.381  0.125  0.770  1.0
  Br  Br25  1  0.881  0.875  0.230  1.0
  Br  Br26  1  0.574  0.292  0.599  1.0
  Br  Br27  1  0.074  0.708  0.401  1.0
  Br  Br28  1  0.326  0.557  0.472  1.0
  Br  Br29  1  0.826  0.443  0.528  1.0
  Br  Br30  1  0.381  0.112  0.271  1.0
  Br  Br31  1  0.881  0.888  0.729  1.0
  N  N32  1  0.523  0.876  0.526  1.0
  N  N33  1  0.023  0.124  0.474  1.0
  N  N34  1  0.363  0.655  0.921  1.0
  N  N35  1  0.863  0.345  0.079  1.0
[/CIF]
.