The crystal structure described by ClC1C2N is Indium-like structured and crystallizes in the monoclinic P2_1/m space group. The structure is zero-dimensional and consists of two ClC1C2N clusters. There are two inequivalent C sites. In the first C site, C(1) is bonded in a distorted single-bond geometry to two equivalent C(2) and one Cl(1) atom. In the second C site, C(2) is bonded in a 3-coordinate geometry to one C(1), one C(2), and one N(1) atom. N(1) is bonded in a 2-coordinate geometry to two equivalent C(2) atoms. Cl(1) is bonded in a single-bond geometry to one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_C3NCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.987
_cell_length_b   4.797
_cell_length_c   6.891
_cell_angle_alpha   76.894
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   224.935
_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
  C  C0  1  0.250  0.169  0.541  1.0
  C  C1  1  0.750  0.831  0.459  1.0
  C  C2  1  0.142  0.250  0.691  1.0
  C  C3  1  0.642  0.750  0.309  1.0
  C  C4  1  0.858  0.750  0.309  1.0
  C  C5  1  0.358  0.250  0.691  1.0
  N  N6  1  0.250  0.307  0.846  1.0
  N  N7  1  0.750  0.693  0.154  1.0
  Cl  Cl8  1  0.250  0.193  0.296  1.0
  Cl  Cl9  1  0.750  0.807  0.704  1.0
[/CIF]
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The crystal structure described by ClC1C2N is Indium-like structured and crystallizes in the monoclinic P2_1/m space group. The structure is zero-dimensional and consists of two ClC1C2N clusters. There are two inequivalent C sites. In the first C site, C(1) is bonded in a distorted single-bond geometry to two equivalent C(2) and one Cl(1) atom. In the second C site, C(2) is bonded in a 3-coordinate geometry to one C(1), one C(2), and one N(1) atom. N(1) is bonded in a 2-coordinate geometry to two equivalent C(2) atoms. Cl(1) is bonded in a single-bond geometry to one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_C3NCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.987
_cell_length_b   4.797
_cell_length_c   6.891
_cell_angle_alpha   76.894
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   224.935
_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
  C  C0  1  0.250  0.169  0.541  1.0
  C  C1  1  0.750  0.831  0.459  1.0
  C  C2  1  0.142  0.250  0.691  1.0
  C  C3  1  0.642  0.750  0.309  1.0
  C  C4  1  0.858  0.750  0.309  1.0
  C  C5  1  0.358  0.250  0.691  1.0
  N  N6  1  0.250  0.307  0.846  1.0
  N  N7  1  0.750  0.693  0.154  1.0
  Cl  Cl8  1  0.250  0.193  0.296  1.0
  Cl  Cl9  1  0.750  0.807  0.704  1.0
[/CIF]
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