The material described by C3IF2 is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four C3IF2 clusters. There are three inequivalent C sites. In the first C site, C(1) is bonded in a distorted single-bond geometry to one C(3) and one F(2) atom. In the second C site, C(2) is bonded in a distorted single-bond geometry to one C(3) and one F(1) atom. In the third C site, C(3) is bonded in a trigonal planar geometry to one C(1), one C(2), and one I(1) atom. I(1) is bonded in a single-bond geometry to one C(3) atom. There are two inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one C(2) atom. In the second F site, F(2) is bonded in a single-bond geometry to one C(1) atom. is represented by the CIF card [CIF]
data_C3IF2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.126
_cell_length_b   8.096
_cell_length_c   9.320
_cell_angle_alpha   79.441
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   454.367
_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
  C  C0  1  0.193  0.969  0.932  1.0
  C  C1  1  0.807  0.031  0.068  1.0
  C  C2  1  0.693  0.031  0.568  1.0
  C  C3  1  0.307  0.969  0.432  1.0
  C  C4  1  0.429  0.836  0.508  1.0
  C  C5  1  0.571  0.164  0.492  1.0
  C  C6  1  0.929  0.164  0.992  1.0
  C  C7  1  0.071  0.836  0.008  1.0
  C  C8  1  0.876  0.865  0.077  1.0
  C  C9  1  0.124  0.135  0.923  1.0
  C  C10  1  0.376  0.135  0.423  1.0
  C  C11  1  0.624  0.865  0.577  1.0
  I  I12  1  0.306  0.335  0.809  1.0
  I  I13  1  0.694  0.665  0.191  1.0
  I  I14  1  0.806  0.665  0.691  1.0
  I  I15  1  0.194  0.335  0.309  1.0
  F  F16  1  0.355  0.678  0.513  1.0
  F  F17  1  0.645  0.322  0.487  1.0
  F  F18  1  0.855  0.322  0.987  1.0
  F  F19  1  0.145  0.678  0.013  1.0
  F  F20  1  0.381  0.935  0.866  1.0
  F  F21  1  0.619  0.065  0.134  1.0
  F  F22  1  0.881  0.065  0.634  1.0
  F  F23  1  0.119  0.935  0.366  1.0
[/CIF]
.
The material described by C3IF2 is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four C3IF2 clusters. There are three inequivalent C sites. In the first C site, C(1) is bonded in a distorted single-bond geometry to one C(3) and one F(2) atom. In the second C site, C(2) is bonded in a distorted single-bond geometry to one C(3) and one F(1) atom. In the third C site, C(3) is bonded in a trigonal planar geometry to one C(1), one C(2), and one I(1) atom. I(1) is bonded in a single-bond geometry to one C(3) atom. There are two inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one C(2) atom. In the second F site, F(2) is bonded in a single-bond geometry to one C(1) atom. is represented by the CIF card [CIF]
data_C3IF2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.126
_cell_length_b   8.096
_cell_length_c   9.320
_cell_angle_alpha   79.441
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   454.367
_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
  C  C0  1  0.193  0.969  0.932  1.0
  C  C1  1  0.807  0.031  0.068  1.0
  C  C2  1  0.693  0.031  0.568  1.0
  C  C3  1  0.307  0.969  0.432  1.0
  C  C4  1  0.429  0.836  0.508  1.0
  C  C5  1  0.571  0.164  0.492  1.0
  C  C6  1  0.929  0.164  0.992  1.0
  C  C7  1  0.071  0.836  0.008  1.0
  C  C8  1  0.876  0.865  0.077  1.0
  C  C9  1  0.124  0.135  0.923  1.0
  C  C10  1  0.376  0.135  0.423  1.0
  C  C11  1  0.624  0.865  0.577  1.0
  I  I12  1  0.306  0.335  0.809  1.0
  I  I13  1  0.694  0.665  0.191  1.0
  I  I14  1  0.806  0.665  0.691  1.0
  I  I15  1  0.194  0.335  0.309  1.0
  F  F16  1  0.355  0.678  0.513  1.0
  F  F17  1  0.645  0.322  0.487  1.0
  F  F18  1  0.855  0.322  0.987  1.0
  F  F19  1  0.145  0.678  0.013  1.0
  F  F20  1  0.381  0.935  0.866  1.0
  F  F21  1  0.619  0.065  0.134  1.0
  F  F22  1  0.881  0.065  0.634  1.0
  F  F23  1  0.119  0.935  0.366  1.0
[/CIF]
.