The material described by ZnC2S4(NO5)2(CO)2 is Indium-derived structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two formaldehyde molecules and one ZnC2S4(NO5)2 cluster. In the ZnC2S4(NO5)2 cluster, Zn(1) is bonded in a 6-coordinate geometry to two equivalent O(1), two equivalent O(4), and two equivalent O(5) atoms. C(1) is bonded in a single-bond geometry to one N(1) atom. N(1) is bonded in a linear geometry to one C(1) and one S(2) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in a bent 120 degrees geometry to one O(1) and one O(2) atom. In the second S site, S(2) is bonded in a water-like geometry to one N(1) and one O(4) atom. There are five inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Zn(1) and one S(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to one S(1) atom. In the third O site, O(4) is bonded in a bent 120 degrees geometry to one Zn(1) and one S(2) atom. In the fourth O site, O(5) is bonded in a bent 120 degrees geometry to one Zn(1) and one O(6) atom. In the fifth O site, O(6) is bonded in a single-bond geometry to one O(5) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_ZnC4S4(NO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.602
_cell_length_b   7.806
_cell_length_c   9.065
_cell_angle_alpha   55.251
_cell_angle_beta   74.286
_cell_angle_gamma   86.305
_symmetry_Int_Tables_number   1
_cell_volume   533.968
_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
  Zn  Zn0  1  0.500  0.000  0.500  1.0
  C  C1  1  0.265  0.389  0.736  1.0
  C  C2  1  0.735  0.611  0.264  1.0
  C  C3  1  0.893  0.150  0.800  1.0
  C  C4  1  0.107  0.850  0.200  1.0
  S  S5  1  0.209  0.591  0.896  1.0
  S  S6  1  0.791  0.409  0.104  1.0
  S  S7  1  0.495  0.134  0.764  1.0
  S  S8  1  0.505  0.866  0.236  1.0
  N  N9  1  0.363  0.288  0.735  1.0
  N  N10  1  0.637  0.712  0.265  1.0
  O  O11  1  0.353  0.707  0.829  1.0
  O  O12  1  0.647  0.293  0.171  1.0
  O  O13  1  0.175  0.397  0.083  1.0
  O  O14  1  0.825  0.603  0.917  1.0
  O  O15  1  0.915  0.159  0.665  1.0
  O  O16  1  0.085  0.841  0.335  1.0
  O  O17  1  0.561  0.163  0.570  1.0
  O  O18  1  0.439  0.837  0.430  1.0
  O  O19  1  0.262  0.111  0.529  1.0
  O  O20  1  0.738  0.889  0.471  1.0
  O  O21  1  0.227  0.291  0.432  1.0
  O  O22  1  0.773  0.709  0.568  1.0
[/CIF]
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The material described by ZnC2S4(NO5)2(CO)2 is Indium-derived structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two formaldehyde molecules and one ZnC2S4(NO5)2 cluster. In the ZnC2S4(NO5)2 cluster, Zn(1) is bonded in a 6-coordinate geometry to two equivalent O(1), two equivalent O(4), and two equivalent O(5) atoms. C(1) is bonded in a single-bond geometry to one N(1) atom. N(1) is bonded in a linear geometry to one C(1) and one S(2) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in a bent 120 degrees geometry to one O(1) and one O(2) atom. In the second S site, S(2) is bonded in a water-like geometry to one N(1) and one O(4) atom. There are five inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Zn(1) and one S(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to one S(1) atom. In the third O site, O(4) is bonded in a bent 120 degrees geometry to one Zn(1) and one S(2) atom. In the fourth O site, O(5) is bonded in a bent 120 degrees geometry to one Zn(1) and one O(6) atom. In the fifth O site, O(6) is bonded in a single-bond geometry to one O(5) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_ZnC4S4(NO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.602
_cell_length_b   7.806
_cell_length_c   9.065
_cell_angle_alpha   55.251
_cell_angle_beta   74.286
_cell_angle_gamma   86.305
_symmetry_Int_Tables_number   1
_cell_volume   533.968
_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
  Zn  Zn0  1  0.500  0.000  0.500  1.0
  C  C1  1  0.265  0.389  0.736  1.0
  C  C2  1  0.735  0.611  0.264  1.0
  C  C3  1  0.893  0.150  0.800  1.0
  C  C4  1  0.107  0.850  0.200  1.0
  S  S5  1  0.209  0.591  0.896  1.0
  S  S6  1  0.791  0.409  0.104  1.0
  S  S7  1  0.495  0.134  0.764  1.0
  S  S8  1  0.505  0.866  0.236  1.0
  N  N9  1  0.363  0.288  0.735  1.0
  N  N10  1  0.637  0.712  0.265  1.0
  O  O11  1  0.353  0.707  0.829  1.0
  O  O12  1  0.647  0.293  0.171  1.0
  O  O13  1  0.175  0.397  0.083  1.0
  O  O14  1  0.825  0.603  0.917  1.0
  O  O15  1  0.915  0.159  0.665  1.0
  O  O16  1  0.085  0.841  0.335  1.0
  O  O17  1  0.561  0.163  0.570  1.0
  O  O18  1  0.439  0.837  0.430  1.0
  O  O19  1  0.262  0.111  0.529  1.0
  O  O20  1  0.738  0.889  0.471  1.0
  O  O21  1  0.227  0.291  0.432  1.0
  O  O22  1  0.773  0.709  0.568  1.0
[/CIF]
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