The crystal structure described by C2NOBr is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two cyanoformyl bromide molecules. There are two inequivalent C sites. In the first C site, C(1) is bonded in a 3-coordinate geometry to one C(2), one O(1), and one Br(1) atom. In the second C site, C(2) is bonded in a distorted linear geometry to one C(1) and one N(1) atom. N(1) is bonded in a single-bond geometry to one C(2) atom. O(1) is bonded in a single-bond geometry to one C(1) atom. Br(1) is bonded in a single-bond geometry to one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_C2BrNO
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.285
_cell_length_b   6.594
_cell_length_c   8.636
_cell_angle_alpha   107.753
_cell_angle_beta   95.315
_cell_angle_gamma   95.749
_symmetry_Int_Tables_number   1
_cell_volume   229.255
_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  0.813  0.361  0.691  1.0
  C  C1  1  0.187  0.639  0.309  1.0
  C  C2  1  0.634  0.239  0.775  1.0
  C  C3  1  0.366  0.761  0.225  1.0
  Br  Br4  1  0.748  0.658  0.766  1.0
  Br  Br5  1  0.252  0.342  0.234  1.0
  N  N6  1  0.489  0.140  0.843  1.0
  N  N7  1  0.511  0.860  0.157  1.0
  O  O8  1  0.981  0.286  0.589  1.0
  O  O9  1  0.019  0.714  0.411  1.0
[/CIF]
.
The crystal structure described by C2NOBr is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two cyanoformyl bromide molecules. There are two inequivalent C sites. In the first C site, C(1) is bonded in a 3-coordinate geometry to one C(2), one O(1), and one Br(1) atom. In the second C site, C(2) is bonded in a distorted linear geometry to one C(1) and one N(1) atom. N(1) is bonded in a single-bond geometry to one C(2) atom. O(1) is bonded in a single-bond geometry to one C(1) atom. Br(1) is bonded in a single-bond geometry to one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_C2BrNO
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.285
_cell_length_b   6.594
_cell_length_c   8.636
_cell_angle_alpha   107.753
_cell_angle_beta   95.315
_cell_angle_gamma   95.749
_symmetry_Int_Tables_number   1
_cell_volume   229.255
_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  0.813  0.361  0.691  1.0
  C  C1  1  0.187  0.639  0.309  1.0
  C  C2  1  0.634  0.239  0.775  1.0
  C  C3  1  0.366  0.761  0.225  1.0
  Br  Br4  1  0.748  0.658  0.766  1.0
  Br  Br5  1  0.252  0.342  0.234  1.0
  N  N6  1  0.489  0.140  0.843  1.0
  N  N7  1  0.511  0.860  0.157  1.0
  O  O8  1  0.981  0.286  0.589  1.0
  O  O9  1  0.019  0.714  0.411  1.0
[/CIF]
.