The material described by RbC2N3 crystallizes in the orthorhombic Pbcm space group. Rb(1) is bonded in a 8-coordinate geometry to two equivalent N(1), two equivalent N(2), and four equivalent N(3) atoms. There are two inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one N(1) and one N(2) atom. In the second C site, C(2) is bonded in a linear geometry to one N(2) and one N(3) atom. There are three inequivalent N sites. In the first N site, N(1) is bonded in a distorted single-bond geometry to two equivalent Rb(1) and one C(1) atom. In the second N site, N(2) is bonded in a distorted bent 120 degrees geometry to two equivalent Rb(1), one C(1), and one C(2) atom. In the third N site, N(3) is bonded in a distorted single-bond geometry to four equivalent Rb(1) and one C(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_RbC2N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.675
_cell_length_b   7.709
_cell_length_c   8.717
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   448.549
_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
  Rb  Rb0  1  0.750  0.000  0.187  1.0
  Rb  Rb1  1  0.250  0.000  0.813  1.0
  Rb  Rb2  1  0.250  0.500  0.813  1.0
  Rb  Rb3  1  0.750  0.500  0.187  1.0
  C  C4  1  0.853  0.250  0.572  1.0
  C  C5  1  0.266  0.750  0.179  1.0
  C  C6  1  0.734  0.250  0.821  1.0
  C  C7  1  0.234  0.250  0.179  1.0
  C  C8  1  0.353  0.250  0.428  1.0
  C  C9  1  0.766  0.750  0.821  1.0
  C  C10  1  0.147  0.750  0.428  1.0
  C  C11  1  0.647  0.750  0.572  1.0
  N  N12  1  0.851  0.250  0.437  1.0
  N  N13  1  0.879  0.250  0.721  1.0
  N  N14  1  0.121  0.750  0.279  1.0
  N  N15  1  0.149  0.750  0.563  1.0
  N  N16  1  0.379  0.250  0.279  1.0
  N  N17  1  0.614  0.250  0.921  1.0
  N  N18  1  0.649  0.750  0.437  1.0
  N  N19  1  0.886  0.750  0.921  1.0
  N  N20  1  0.621  0.750  0.721  1.0
  N  N21  1  0.351  0.250  0.563  1.0
  N  N22  1  0.386  0.750  0.079  1.0
  N  N23  1  0.114  0.250  0.079  1.0
[/CIF]
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The material described by RbC2N3 crystallizes in the orthorhombic Pbcm space group. Rb(1) is bonded in a 8-coordinate geometry to two equivalent N(1), two equivalent N(2), and four equivalent N(3) atoms. There are two inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one N(1) and one N(2) atom. In the second C site, C(2) is bonded in a linear geometry to one N(2) and one N(3) atom. There are three inequivalent N sites. In the first N site, N(1) is bonded in a distorted single-bond geometry to two equivalent Rb(1) and one C(1) atom. In the second N site, N(2) is bonded in a distorted bent 120 degrees geometry to two equivalent Rb(1), one C(1), and one C(2) atom. In the third N site, N(3) is bonded in a distorted single-bond geometry to four equivalent Rb(1) and one C(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_RbC2N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.675
_cell_length_b   7.709
_cell_length_c   8.717
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   448.549
_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
  Rb  Rb0  1  0.750  0.000  0.187  1.0
  Rb  Rb1  1  0.250  0.000  0.813  1.0
  Rb  Rb2  1  0.250  0.500  0.813  1.0
  Rb  Rb3  1  0.750  0.500  0.187  1.0
  C  C4  1  0.853  0.250  0.572  1.0
  C  C5  1  0.266  0.750  0.179  1.0
  C  C6  1  0.734  0.250  0.821  1.0
  C  C7  1  0.234  0.250  0.179  1.0
  C  C8  1  0.353  0.250  0.428  1.0
  C  C9  1  0.766  0.750  0.821  1.0
  C  C10  1  0.147  0.750  0.428  1.0
  C  C11  1  0.647  0.750  0.572  1.0
  N  N12  1  0.851  0.250  0.437  1.0
  N  N13  1  0.879  0.250  0.721  1.0
  N  N14  1  0.121  0.750  0.279  1.0
  N  N15  1  0.149  0.750  0.563  1.0
  N  N16  1  0.379  0.250  0.279  1.0
  N  N17  1  0.614  0.250  0.921  1.0
  N  N18  1  0.649  0.750  0.437  1.0
  N  N19  1  0.886  0.750  0.921  1.0
  N  N20  1  0.621  0.750  0.721  1.0
  N  N21  1  0.351  0.250  0.563  1.0
  N  N22  1  0.386  0.750  0.079  1.0
  N  N23  1  0.114  0.250  0.079  1.0
[/CIF]
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