The crystal structure described by PN3H6O is beta Np structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four phosphoramide molecules. P(1) is bonded in a tetrahedral geometry to one N(1), one N(2), one N(3), and one O(1) atom. There are three inequivalent N sites. In the first N site, N(2) is bonded in a distorted trigonal non-coplanar geometry to one P(1), one H(3), and one H(4) atom. In the second N site, N(3) is bonded in a trigonal planar geometry to one P(1), one H(5), and one H(6) atom. In the third N site, N(1) is bonded in a distorted trigonal non-coplanar geometry to one P(1), one H(1), and one H(2) atom. There are six inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one N(1) atom. In the second H site, H(2) is bonded in a single-bond geometry to one N(1) atom. In the third H site, H(3) is bonded in a single-bond geometry to one N(2) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one N(2) atom. In the fifth H site, H(5) is bonded in a single-bond geometry to one N(3) atom. In the sixth H site, H(6) is bonded in a single-bond geometry to one N(3) atom. O(1) is bonded in a single-bond geometry to one P(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_PH6N3O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.920
_cell_length_b   5.448
_cell_length_c   8.565
_cell_angle_alpha   85.553
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   414.994
_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
  P  P0  1  0.526  0.334  0.252  1.0
  P  P1  1  0.026  0.166  0.748  1.0
  P  P2  1  0.474  0.666  0.748  1.0
  P  P3  1  0.974  0.834  0.252  1.0
  H  H4  1  0.734  0.431  0.106  1.0
  H  H5  1  0.234  0.069  0.894  1.0
  H  H6  1  0.266  0.569  0.894  1.0
  H  H7  1  0.766  0.931  0.106  1.0
  H  H8  1  0.603  0.299  0.997  1.0
  H  H9  1  0.103  0.201  0.003  1.0
  H  H10  1  0.397  0.701  0.003  1.0
  H  H11  1  0.897  0.799  0.997  1.0
  H  H12  1  0.709  0.140  0.401  1.0
  H  H13  1  0.209  0.360  0.599  1.0
  H  H14  1  0.291  0.860  0.599  1.0
  H  H15  1  0.791  0.640  0.401  1.0
  H  H16  1  0.604  0.323  0.511  1.0
  H  H17  1  0.104  0.177  0.489  1.0
  H  H18  1  0.396  0.677  0.489  1.0
  H  H19  1  0.896  0.823  0.511  1.0
  H  H20  1  0.296  0.133  0.254  1.0
  H  H21  1  0.796  0.367  0.746  1.0
  H  H22  1  0.704  0.867  0.746  1.0
  H  H23  1  0.204  0.633  0.254  1.0
  H  H24  1  0.441  0.932  0.233  1.0
  H  H25  1  0.941  0.568  0.767  1.0
  H  H26  1  0.559  0.068  0.767  1.0
  H  H27  1  0.059  0.432  0.233  1.0
  N  N28  1  0.647  0.307  0.107  1.0
  N  N29  1  0.147  0.193  0.893  1.0
  N  N30  1  0.353  0.693  0.893  1.0
  N  N31  1  0.853  0.807  0.107  1.0
  N  N32  1  0.645  0.296  0.402  1.0
  N  N33  1  0.145  0.204  0.598  1.0
  N  N34  1  0.355  0.704  0.598  1.0
  N  N35  1  0.855  0.796  0.402  1.0
  N  N36  1  0.406  0.111  0.224  1.0
  N  N37  1  0.906  0.389  0.776  1.0
  N  N38  1  0.594  0.889  0.776  1.0
  N  N39  1  0.094  0.611  0.224  1.0
  O  O40  1  0.439  0.570  0.263  1.0
  O  O41  1  0.939  0.930  0.737  1.0
  O  O42  1  0.561  0.430  0.737  1.0
  O  O43  1  0.061  0.070  0.263  1.0
[/CIF]
.
The crystal structure described by PN3H6O is beta Np structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four phosphoramide molecules. P(1) is bonded in a tetrahedral geometry to one N(1), one N(2), one N(3), and one O(1) atom. There are three inequivalent N sites. In the first N site, N(2) is bonded in a distorted trigonal non-coplanar geometry to one P(1), one H(3), and one H(4) atom. In the second N site, N(3) is bonded in a trigonal planar geometry to one P(1), one H(5), and one H(6) atom. In the third N site, N(1) is bonded in a distorted trigonal non-coplanar geometry to one P(1), one H(1), and one H(2) atom. There are six inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one N(1) atom. In the second H site, H(2) is bonded in a single-bond geometry to one N(1) atom. In the third H site, H(3) is bonded in a single-bond geometry to one N(2) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one N(2) atom. In the fifth H site, H(5) is bonded in a single-bond geometry to one N(3) atom. In the sixth H site, H(6) is bonded in a single-bond geometry to one N(3) atom. O(1) is bonded in a single-bond geometry to one P(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_PH6N3O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.920
_cell_length_b   5.448
_cell_length_c   8.565
_cell_angle_alpha   85.553
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   414.994
_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
  P  P0  1  0.526  0.334  0.252  1.0
  P  P1  1  0.026  0.166  0.748  1.0
  P  P2  1  0.474  0.666  0.748  1.0
  P  P3  1  0.974  0.834  0.252  1.0
  H  H4  1  0.734  0.431  0.106  1.0
  H  H5  1  0.234  0.069  0.894  1.0
  H  H6  1  0.266  0.569  0.894  1.0
  H  H7  1  0.766  0.931  0.106  1.0
  H  H8  1  0.603  0.299  0.997  1.0
  H  H9  1  0.103  0.201  0.003  1.0
  H  H10  1  0.397  0.701  0.003  1.0
  H  H11  1  0.897  0.799  0.997  1.0
  H  H12  1  0.709  0.140  0.401  1.0
  H  H13  1  0.209  0.360  0.599  1.0
  H  H14  1  0.291  0.860  0.599  1.0
  H  H15  1  0.791  0.640  0.401  1.0
  H  H16  1  0.604  0.323  0.511  1.0
  H  H17  1  0.104  0.177  0.489  1.0
  H  H18  1  0.396  0.677  0.489  1.0
  H  H19  1  0.896  0.823  0.511  1.0
  H  H20  1  0.296  0.133  0.254  1.0
  H  H21  1  0.796  0.367  0.746  1.0
  H  H22  1  0.704  0.867  0.746  1.0
  H  H23  1  0.204  0.633  0.254  1.0
  H  H24  1  0.441  0.932  0.233  1.0
  H  H25  1  0.941  0.568  0.767  1.0
  H  H26  1  0.559  0.068  0.767  1.0
  H  H27  1  0.059  0.432  0.233  1.0
  N  N28  1  0.647  0.307  0.107  1.0
  N  N29  1  0.147  0.193  0.893  1.0
  N  N30  1  0.353  0.693  0.893  1.0
  N  N31  1  0.853  0.807  0.107  1.0
  N  N32  1  0.645  0.296  0.402  1.0
  N  N33  1  0.145  0.204  0.598  1.0
  N  N34  1  0.355  0.704  0.598  1.0
  N  N35  1  0.855  0.796  0.402  1.0
  N  N36  1  0.406  0.111  0.224  1.0
  N  N37  1  0.906  0.389  0.776  1.0
  N  N38  1  0.594  0.889  0.776  1.0
  N  N39  1  0.094  0.611  0.224  1.0
  O  O40  1  0.439  0.570  0.263  1.0
  O  O41  1  0.939  0.930  0.737  1.0
  O  O42  1  0.561  0.430  0.737  1.0
  O  O43  1  0.061  0.070  0.263  1.0
[/CIF]
.