The material described by RbCN5H2 crystallizes in the orthorhombic Pnma space group. Rb(1) is bonded in a 9-coordinate geometry to one N(2), four equivalent N(1), and four equivalent N(3) atoms. C(1) is bonded in a trigonal planar geometry to one N(2) and two equivalent N(1) atoms. 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), one C(1), and one N(3) atom. In the second N site, N(2) is bonded in a distorted trigonal non-coplanar geometry to one Rb(1), one C(1), and two equivalent H(1) atoms. In the third N site, N(3) is bonded in a 2-coordinate geometry to two equivalent Rb(1), one N(1), and one N(3) atom. H(1) is bonded in a single-bond geometry to one N(2) atom. is represented by the CIF card [CIF]
data_RbH2CN5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.772
_cell_length_b   8.227
_cell_length_c   9.126
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   508.438
_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  0.981  0.290  1.0
  Rb  Rb1  1  0.250  0.019  0.710  1.0
  Rb  Rb2  1  0.250  0.519  0.790  1.0
  Rb  Rb3  1  0.750  0.481  0.210  1.0
  H  H4  1  0.877  0.721  0.570  1.0
  H  H5  1  0.123  0.279  0.430  1.0
  H  H6  1  0.123  0.779  0.070  1.0
  H  H7  1  0.377  0.279  0.430  1.0
  H  H8  1  0.877  0.221  0.930  1.0
  H  H9  1  0.623  0.721  0.570  1.0
  H  H10  1  0.623  0.221  0.930  1.0
  H  H11  1  0.377  0.779  0.070  1.0
  C  C12  1  0.750  0.786  0.761  1.0
  C  C13  1  0.250  0.214  0.239  1.0
  C  C14  1  0.250  0.714  0.261  1.0
  C  C15  1  0.750  0.286  0.739  1.0
  N  N16  1  0.915  0.794  0.843  1.0
  N  N17  1  0.085  0.206  0.157  1.0
  N  N18  1  0.085  0.706  0.343  1.0
  N  N19  1  0.415  0.206  0.157  1.0
  N  N20  1  0.915  0.294  0.657  1.0
  N  N21  1  0.585  0.794  0.843  1.0
  N  N22  1  0.585  0.294  0.657  1.0
  N  N23  1  0.415  0.706  0.343  1.0
  N  N24  1  0.750  0.773  0.610  1.0
  N  N25  1  0.250  0.227  0.390  1.0
  N  N26  1  0.250  0.727  0.110  1.0
  N  N27  1  0.750  0.273  0.890  1.0
  N  N28  1  0.847  0.807  0.983  1.0
  N  N29  1  0.153  0.193  0.017  1.0
  N  N30  1  0.153  0.693  0.483  1.0
  N  N31  1  0.347  0.193  0.017  1.0
  N  N32  1  0.847  0.307  0.517  1.0
  N  N33  1  0.653  0.807  0.983  1.0
  N  N34  1  0.653  0.307  0.517  1.0
  N  N35  1  0.347  0.693  0.483  1.0
[/CIF]
.
The material described by RbCN5H2 crystallizes in the orthorhombic Pnma space group. Rb(1) is bonded in a 9-coordinate geometry to one N(2), four equivalent N(1), and four equivalent N(3) atoms. C(1) is bonded in a trigonal planar geometry to one N(2) and two equivalent N(1) atoms. 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), one C(1), and one N(3) atom. In the second N site, N(2) is bonded in a distorted trigonal non-coplanar geometry to one Rb(1), one C(1), and two equivalent H(1) atoms. In the third N site, N(3) is bonded in a 2-coordinate geometry to two equivalent Rb(1), one N(1), and one N(3) atom. H(1) is bonded in a single-bond geometry to one N(2) atom. is represented by the CIF card [CIF]
data_RbH2CN5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.772
_cell_length_b   8.227
_cell_length_c   9.126
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   508.438
_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  0.981  0.290  1.0
  Rb  Rb1  1  0.250  0.019  0.710  1.0
  Rb  Rb2  1  0.250  0.519  0.790  1.0
  Rb  Rb3  1  0.750  0.481  0.210  1.0
  H  H4  1  0.877  0.721  0.570  1.0
  H  H5  1  0.123  0.279  0.430  1.0
  H  H6  1  0.123  0.779  0.070  1.0
  H  H7  1  0.377  0.279  0.430  1.0
  H  H8  1  0.877  0.221  0.930  1.0
  H  H9  1  0.623  0.721  0.570  1.0
  H  H10  1  0.623  0.221  0.930  1.0
  H  H11  1  0.377  0.779  0.070  1.0
  C  C12  1  0.750  0.786  0.761  1.0
  C  C13  1  0.250  0.214  0.239  1.0
  C  C14  1  0.250  0.714  0.261  1.0
  C  C15  1  0.750  0.286  0.739  1.0
  N  N16  1  0.915  0.794  0.843  1.0
  N  N17  1  0.085  0.206  0.157  1.0
  N  N18  1  0.085  0.706  0.343  1.0
  N  N19  1  0.415  0.206  0.157  1.0
  N  N20  1  0.915  0.294  0.657  1.0
  N  N21  1  0.585  0.794  0.843  1.0
  N  N22  1  0.585  0.294  0.657  1.0
  N  N23  1  0.415  0.706  0.343  1.0
  N  N24  1  0.750  0.773  0.610  1.0
  N  N25  1  0.250  0.227  0.390  1.0
  N  N26  1  0.250  0.727  0.110  1.0
  N  N27  1  0.750  0.273  0.890  1.0
  N  N28  1  0.847  0.807  0.983  1.0
  N  N29  1  0.153  0.193  0.017  1.0
  N  N30  1  0.153  0.693  0.483  1.0
  N  N31  1  0.347  0.193  0.017  1.0
  N  N32  1  0.847  0.307  0.517  1.0
  N  N33  1  0.653  0.807  0.983  1.0
  N  N34  1  0.653  0.307  0.517  1.0
  N  N35  1  0.347  0.693  0.483  1.0
[/CIF]
.