The material described by Nd(C2N3)3 crystallizes in the orthorhombic Cmcm space group. Nd(1) is bonded in a 9-coordinate geometry to one N(2), two equivalent N(3), two equivalent N(4), and four equivalent N(1) atoms. There are two inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one N(2) and one N(3) atom. In the second C site, C(2) is bonded in a linear geometry to one N(1) and one N(4) atom. There are four inequivalent N sites. In the first N site, N(3) is bonded in a distorted bent 150 degrees geometry to one Nd(1) and one C(1) atom. In the second N site, N(4) is bonded in a bent 120 degrees geometry to one Nd(1) and two equivalent C(2) atoms. In the third N site, N(1) is bonded in a bent 150 degrees geometry to one Nd(1) and one C(2) atom. In the fourth N site, N(2) is bonded in a distorted bent 120 degrees geometry to one Nd(1) and two equivalent C(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Nd(C2N3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.992
_cell_length_b   6.992
_cell_length_c   10.250
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   111.538
_symmetry_Int_Tables_number   1
_cell_volume   466.147
_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
  Nd  Nd0  1  0.716  0.284  0.750  1.0
  Nd  Nd1  1  0.284  0.716  0.250  1.0
  C  C2  1  0.727  0.559  0.250  1.0
  C  C3  1  0.999  0.289  0.449  1.0
  C  C4  1  0.001  0.711  0.949  1.0
  C  C5  1  0.273  0.441  0.750  1.0
  C  C6  1  0.559  0.727  0.750  1.0
  C  C7  1  0.441  0.273  0.250  1.0
  C  C8  1  0.289  0.999  0.949  1.0
  C  C9  1  0.711  0.001  0.449  1.0
  C  C10  1  0.999  0.289  0.051  1.0
  C  C11  1  0.001  0.711  0.551  1.0
  C  C12  1  0.711  0.001  0.051  1.0
  C  C13  1  0.289  0.999  0.551  1.0
  N  N14  1  0.142  0.416  0.403  1.0
  N  N15  1  0.858  0.584  0.903  1.0
  N  N16  1  0.528  0.472  0.250  1.0
  N  N17  1  0.472  0.528  0.750  1.0
  N  N18  1  0.905  0.647  0.250  1.0
  N  N19  1  0.095  0.353  0.750  1.0
  N  N20  1  0.647  0.905  0.750  1.0
  N  N21  1  0.353  0.095  0.250  1.0
  N  N22  1  0.158  0.842  0.010  1.0
  N  N23  1  0.842  0.158  0.510  1.0
  N  N24  1  0.842  0.158  0.990  1.0
  N  N25  1  0.158  0.842  0.490  1.0
  N  N26  1  0.416  0.142  0.903  1.0
  N  N27  1  0.584  0.858  0.403  1.0
  N  N28  1  0.142  0.416  0.097  1.0
  N  N29  1  0.858  0.584  0.597  1.0
  N  N30  1  0.584  0.858  0.097  1.0
  N  N31  1  0.416  0.142  0.597  1.0
[/CIF]
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The material described by Nd(C2N3)3 crystallizes in the orthorhombic Cmcm space group. Nd(1) is bonded in a 9-coordinate geometry to one N(2), two equivalent N(3), two equivalent N(4), and four equivalent N(1) atoms. There are two inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one N(2) and one N(3) atom. In the second C site, C(2) is bonded in a linear geometry to one N(1) and one N(4) atom. There are four inequivalent N sites. In the first N site, N(3) is bonded in a distorted bent 150 degrees geometry to one Nd(1) and one C(1) atom. In the second N site, N(4) is bonded in a bent 120 degrees geometry to one Nd(1) and two equivalent C(2) atoms. In the third N site, N(1) is bonded in a bent 150 degrees geometry to one Nd(1) and one C(2) atom. In the fourth N site, N(2) is bonded in a distorted bent 120 degrees geometry to one Nd(1) and two equivalent C(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Nd(C2N3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.992
_cell_length_b   6.992
_cell_length_c   10.250
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   111.538
_symmetry_Int_Tables_number   1
_cell_volume   466.147
_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
  Nd  Nd0  1  0.716  0.284  0.750  1.0
  Nd  Nd1  1  0.284  0.716  0.250  1.0
  C  C2  1  0.727  0.559  0.250  1.0
  C  C3  1  0.999  0.289  0.449  1.0
  C  C4  1  0.001  0.711  0.949  1.0
  C  C5  1  0.273  0.441  0.750  1.0
  C  C6  1  0.559  0.727  0.750  1.0
  C  C7  1  0.441  0.273  0.250  1.0
  C  C8  1  0.289  0.999  0.949  1.0
  C  C9  1  0.711  0.001  0.449  1.0
  C  C10  1  0.999  0.289  0.051  1.0
  C  C11  1  0.001  0.711  0.551  1.0
  C  C12  1  0.711  0.001  0.051  1.0
  C  C13  1  0.289  0.999  0.551  1.0
  N  N14  1  0.142  0.416  0.403  1.0
  N  N15  1  0.858  0.584  0.903  1.0
  N  N16  1  0.528  0.472  0.250  1.0
  N  N17  1  0.472  0.528  0.750  1.0
  N  N18  1  0.905  0.647  0.250  1.0
  N  N19  1  0.095  0.353  0.750  1.0
  N  N20  1  0.647  0.905  0.750  1.0
  N  N21  1  0.353  0.095  0.250  1.0
  N  N22  1  0.158  0.842  0.010  1.0
  N  N23  1  0.842  0.158  0.510  1.0
  N  N24  1  0.842  0.158  0.990  1.0
  N  N25  1  0.158  0.842  0.490  1.0
  N  N26  1  0.416  0.142  0.903  1.0
  N  N27  1  0.584  0.858  0.403  1.0
  N  N28  1  0.142  0.416  0.097  1.0
  N  N29  1  0.858  0.584  0.597  1.0
  N  N30  1  0.584  0.858  0.097  1.0
  N  N31  1  0.416  0.142  0.597  1.0
[/CIF]
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