The compound described by V2CuH18(N3O5)2 is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of one V2CuH18(N3O5)2 cluster. V(1) is bonded in a 6-coordinate geometry to one N(1), one O(1), one O(2), one O(3), one O(4), and one O(5) atom. Cu(1) is bonded in a distorted square co-planar geometry to two equivalent N(2), two equivalent N(3), and two equivalent O(4) atoms. There are three inequivalent N sites. In the first N site, N(1) is bonded in a distorted trigonal non-coplanar geometry to one V(1), one H(1), one H(2), and one H(3) atom. In the second N site, N(2) is bonded in a distorted trigonal non-coplanar geometry to one Cu(1), one H(4), one H(5), and one H(6) atom. In the third N site, N(3) is bonded in a distorted trigonal non-coplanar geometry to one Cu(1), one H(7), one H(8), and one H(9) atom. There are nine 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(1) 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(2) atom. In the sixth H site, H(6) is bonded in a single-bond geometry to one N(2) atom. In the seventh H site, H(7) is bonded in a single-bond geometry to one N(3) atom. In the eighth H site, H(8) is bonded in a single-bond geometry to one N(3) atom. In the ninth H site, H(9) is bonded in a single-bond geometry to one N(3) atom. There are five inequivalent O sites. In the first O site, O(1) is bonded in a 2-coordinate geometry to one V(1) and one O(2) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one V(1) and one O(1) atom. In the third O site, O(3) is bonded in a 2-coordinate geometry to one V(1) and one O(4) atom. In the fourth O site, O(4) is bonded in a 1-coordinate geometry to one V(1), one Cu(1), and one O(3) atom. In the fifth O site, O(5) is bonded in a single-bond geometry to one V(1) atom. is represented by the CIF file [CIF]
data_V2CuH18(N3O5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.481
_cell_length_b   7.516
_cell_length_c   7.666
_cell_angle_alpha   60.762
_cell_angle_beta   76.689
_cell_angle_gamma   74.828
_symmetry_Int_Tables_number   1
_cell_volume   360.353
_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
  V  V0  1  0.840  0.416  0.768  1.0
  V  V1  1  0.160  0.584  0.232  1.0
  Cu  Cu2  1  0.500  0.000  0.500  1.0
  H  H3  1  0.136  0.172  0.947  1.0
  H  H4  1  0.864  0.828  0.053  1.0
  H  H5  1  0.204  0.336  0.707  1.0
  H  H6  1  0.796  0.664  0.293  1.0
  H  H7  1  0.154  0.411  0.891  1.0
  H  H8  1  0.846  0.589  0.109  1.0
  H  H9  1  0.387  0.905  0.876  1.0
  H  H10  1  0.613  0.095  0.124  1.0
  H  H11  1  0.598  0.779  0.846  1.0
  H  H12  1  0.402  0.221  0.154  1.0
  H  H13  1  0.567  0.029  0.796  1.0
  H  H14  1  0.433  0.971  0.204  1.0
  H  H15  1  0.846  0.008  0.422  1.0
  H  H16  1  0.154  0.992  0.578  1.0
  H  H17  1  0.739  0.241  0.267  1.0
  H  H18  1  0.261  0.759  0.733  1.0
  H  H19  1  0.748  0.184  0.505  1.0
  H  H20  1  0.252  0.816  0.495  1.0
  N  N21  1  0.118  0.323  0.839  1.0
  N  N22  1  0.882  0.677  0.161  1.0
  N  N23  1  0.513  0.921  0.788  1.0
  N  N24  1  0.487  0.079  0.212  1.0
  N  N25  1  0.735  0.125  0.413  1.0
  N  N26  1  0.265  0.875  0.587  1.0
  O  O27  1  0.855  0.129  0.854  1.0
  O  O28  1  0.145  0.871  0.146  1.0
  O  O29  1  0.692  0.256  0.747  1.0
  O  O30  1  0.308  0.744  0.253  1.0
  O  O31  1  0.926  0.662  0.562  1.0
  O  O32  1  0.074  0.338  0.438  1.0
  O  O33  1  0.737  0.657  0.544  1.0
  O  O34  1  0.263  0.343  0.456  1.0
  O  O35  1  0.748  0.456  0.968  1.0
  O  O36  1  0.252  0.544  0.032  1.0
[/CIF]
.
The compound described by V2CuH18(N3O5)2 is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of one V2CuH18(N3O5)2 cluster. V(1) is bonded in a 6-coordinate geometry to one N(1), one O(1), one O(2), one O(3), one O(4), and one O(5) atom. Cu(1) is bonded in a distorted square co-planar geometry to two equivalent N(2), two equivalent N(3), and two equivalent O(4) atoms. There are three inequivalent N sites. In the first N site, N(1) is bonded in a distorted trigonal non-coplanar geometry to one V(1), one H(1), one H(2), and one H(3) atom. In the second N site, N(2) is bonded in a distorted trigonal non-coplanar geometry to one Cu(1), one H(4), one H(5), and one H(6) atom. In the third N site, N(3) is bonded in a distorted trigonal non-coplanar geometry to one Cu(1), one H(7), one H(8), and one H(9) atom. There are nine 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(1) 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(2) atom. In the sixth H site, H(6) is bonded in a single-bond geometry to one N(2) atom. In the seventh H site, H(7) is bonded in a single-bond geometry to one N(3) atom. In the eighth H site, H(8) is bonded in a single-bond geometry to one N(3) atom. In the ninth H site, H(9) is bonded in a single-bond geometry to one N(3) atom. There are five inequivalent O sites. In the first O site, O(1) is bonded in a 2-coordinate geometry to one V(1) and one O(2) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one V(1) and one O(1) atom. In the third O site, O(3) is bonded in a 2-coordinate geometry to one V(1) and one O(4) atom. In the fourth O site, O(4) is bonded in a 1-coordinate geometry to one V(1), one Cu(1), and one O(3) atom. In the fifth O site, O(5) is bonded in a single-bond geometry to one V(1) atom. is represented by the CIF file [CIF]
data_V2CuH18(N3O5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.481
_cell_length_b   7.516
_cell_length_c   7.666
_cell_angle_alpha   60.762
_cell_angle_beta   76.689
_cell_angle_gamma   74.828
_symmetry_Int_Tables_number   1
_cell_volume   360.353
_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
  V  V0  1  0.840  0.416  0.768  1.0
  V  V1  1  0.160  0.584  0.232  1.0
  Cu  Cu2  1  0.500  0.000  0.500  1.0
  H  H3  1  0.136  0.172  0.947  1.0
  H  H4  1  0.864  0.828  0.053  1.0
  H  H5  1  0.204  0.336  0.707  1.0
  H  H6  1  0.796  0.664  0.293  1.0
  H  H7  1  0.154  0.411  0.891  1.0
  H  H8  1  0.846  0.589  0.109  1.0
  H  H9  1  0.387  0.905  0.876  1.0
  H  H10  1  0.613  0.095  0.124  1.0
  H  H11  1  0.598  0.779  0.846  1.0
  H  H12  1  0.402  0.221  0.154  1.0
  H  H13  1  0.567  0.029  0.796  1.0
  H  H14  1  0.433  0.971  0.204  1.0
  H  H15  1  0.846  0.008  0.422  1.0
  H  H16  1  0.154  0.992  0.578  1.0
  H  H17  1  0.739  0.241  0.267  1.0
  H  H18  1  0.261  0.759  0.733  1.0
  H  H19  1  0.748  0.184  0.505  1.0
  H  H20  1  0.252  0.816  0.495  1.0
  N  N21  1  0.118  0.323  0.839  1.0
  N  N22  1  0.882  0.677  0.161  1.0
  N  N23  1  0.513  0.921  0.788  1.0
  N  N24  1  0.487  0.079  0.212  1.0
  N  N25  1  0.735  0.125  0.413  1.0
  N  N26  1  0.265  0.875  0.587  1.0
  O  O27  1  0.855  0.129  0.854  1.0
  O  O28  1  0.145  0.871  0.146  1.0
  O  O29  1  0.692  0.256  0.747  1.0
  O  O30  1  0.308  0.744  0.253  1.0
  O  O31  1  0.926  0.662  0.562  1.0
  O  O32  1  0.074  0.338  0.438  1.0
  O  O33  1  0.737  0.657  0.544  1.0
  O  O34  1  0.263  0.343  0.456  1.0
  O  O35  1  0.748  0.456  0.968  1.0
  O  O36  1  0.252  0.544  0.032  1.0
[/CIF]
.