The crystal structure described by CN2H5SnCl3 is Pb (Zr_0.50 Ti_0.48) O_3 structured and crystallizes in the orthorhombic Amm2 space group. The structure consists of two iminomethanaminium molecules inside a SnCl3 framework. In the SnCl3 framework, Sn(1) is bonded to two equivalent Cl(2) and four equivalent Cl(1) atoms to form corner-sharing SnCl6 octahedra. The corner-sharing octahedral tilt angles range from 5-7°. There are two inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a linear geometry to two equivalent Sn(1) atoms. In the second Cl site, Cl(2) is bonded in a linear geometry to two equivalent Sn(1) atoms. is represented by the CIF card [CIF]
data_SnH5CN2Cl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.040
_cell_length_b   5.670
_cell_length_c   5.670
_cell_angle_alpha   94.212
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   193.666
_cell_formula_units_Z   1
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
  Sn  Sn0  1  0.500  0.372  0.628  1.0
  H  H1  1  0.795  0.726  0.274  1.0
  H  H2  1  0.205  0.726  0.274  1.0
  H  H3  1  0.670  0.916  0.084  1.0
  H  H4  1  0.330  0.916  0.084  1.0
  H  H5  1  0.000  0.053  0.947  1.0
  C  C6  1  0.000  0.922  0.078  1.0
  N  N7  1  0.809  0.848  0.152  1.0
  N  N8  1  0.191  0.848  0.152  1.0
  Cl  Cl9  1  0.500  0.856  0.649  1.0
  Cl  Cl10  1  0.500  0.351  0.144  1.0
  Cl  Cl11  1  0.000  0.394  0.606  1.0
[/CIF]
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The crystal structure described by CN2H5SnCl3 is Pb (Zr_0.50 Ti_0.48) O_3 structured and crystallizes in the orthorhombic Amm2 space group. The structure consists of two iminomethanaminium molecules inside a SnCl3 framework. In the SnCl3 framework, Sn(1) is bonded to two equivalent Cl(2) and four equivalent Cl(1) atoms to form corner-sharing SnCl6 octahedra. The corner-sharing octahedral tilt angles range from 5-7°. There are two inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a linear geometry to two equivalent Sn(1) atoms. In the second Cl site, Cl(2) is bonded in a linear geometry to two equivalent Sn(1) atoms. is represented by the CIF card [CIF]
data_SnH5CN2Cl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.040
_cell_length_b   5.670
_cell_length_c   5.670
_cell_angle_alpha   94.212
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   193.666
_cell_formula_units_Z   1
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
  Sn  Sn0  1  0.500  0.372  0.628  1.0
  H  H1  1  0.795  0.726  0.274  1.0
  H  H2  1  0.205  0.726  0.274  1.0
  H  H3  1  0.670  0.916  0.084  1.0
  H  H4  1  0.330  0.916  0.084  1.0
  H  H5  1  0.000  0.053  0.947  1.0
  C  C6  1  0.000  0.922  0.078  1.0
  N  N7  1  0.809  0.848  0.152  1.0
  N  N8  1  0.191  0.848  0.152  1.0
  Cl  Cl9  1  0.500  0.856  0.649  1.0
  Cl  Cl10  1  0.500  0.351  0.144  1.0
  Cl  Cl11  1  0.000  0.394  0.606  1.0
[/CIF]
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