The material structure described by Mn(C2O)2(CO)2O2 is Cyanogen Chloride-like structured and crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of eight formaldehyde molecules, four hydrogen peroxide molecules, and four Mn(C2O)2 clusters. In each Mn(C2O)2 cluster, Mn(1) is bonded in a linear geometry to two equivalent C(2) atoms. There are two inequivalent C sites. In the first C site, C(3) is bonded in a distorted single-bond geometry to one C(2) and one O(2) atom. In the second C site, C(2) is bonded in a distorted bent 150 degrees geometry to one Mn(1) and one C(3) atom. O(2) is bonded in a single-bond geometry to one C(3) atom. is represented by the CIF card [CIF]
data_Mn(CO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.807
_cell_length_b   8.807
_cell_length_c   19.956
_cell_angle_alpha   88.949
_cell_angle_beta   88.949
_cell_angle_gamma   116.060
_symmetry_Int_Tables_number   1
_cell_volume   1389.612
_cell_formula_units_Z   2
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
  Mn  Mn0  1  0.500  0.000  0.500  1.0
  Mn  Mn1  1  0.000  0.500  0.000  1.0
  C  C2  1  0.484  0.108  0.745  1.0
  C  C3  1  0.516  0.892  0.255  1.0
  C  C4  1  0.729  0.028  0.499  1.0
  C  C5  1  0.892  0.516  0.755  1.0
  C  C6  1  0.271  0.972  0.501  1.0
  C  C7  1  0.108  0.484  0.245  1.0
  C  C8  1  0.107  0.894  0.500  1.0
  C  C9  1  0.972  0.271  0.001  1.0
  C  C10  1  0.893  0.106  0.500  1.0
  C  C11  1  0.028  0.729  0.999  1.0
  C  C12  1  0.106  0.893  1.000  1.0
  C  C13  1  0.894  0.107  0.000  1.0
  O  O14  1  0.470  0.662  0.748  1.0
  O  O15  1  0.530  0.338  0.252  1.0
  O  O16  1  0.957  0.815  0.500  1.0
  O  O17  1  0.338  0.530  0.752  1.0
  O  O18  1  0.043  0.185  0.500  1.0
  O  O19  1  0.662  0.470  0.248  1.0
  O  O20  1  0.375  0.042  0.783  1.0
  O  O21  1  0.185  0.043  1.000  1.0
  O  O22  1  0.625  0.958  0.217  1.0
  O  O23  1  0.815  0.957  0.000  1.0
  O  O24  1  0.958  0.625  0.717  1.0
  O  O25  1  0.042  0.375  0.283  1.0
[/CIF]
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The material structure described by Mn(C2O)2(CO)2O2 is Cyanogen Chloride-like structured and crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of eight formaldehyde molecules, four hydrogen peroxide molecules, and four Mn(C2O)2 clusters. In each Mn(C2O)2 cluster, Mn(1) is bonded in a linear geometry to two equivalent C(2) atoms. There are two inequivalent C sites. In the first C site, C(3) is bonded in a distorted single-bond geometry to one C(2) and one O(2) atom. In the second C site, C(2) is bonded in a distorted bent 150 degrees geometry to one Mn(1) and one C(3) atom. O(2) is bonded in a single-bond geometry to one C(3) atom. is represented by the CIF card [CIF]
data_Mn(CO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.807
_cell_length_b   8.807
_cell_length_c   19.956
_cell_angle_alpha   88.949
_cell_angle_beta   88.949
_cell_angle_gamma   116.060
_symmetry_Int_Tables_number   1
_cell_volume   1389.612
_cell_formula_units_Z   2
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
  Mn  Mn0  1  0.500  0.000  0.500  1.0
  Mn  Mn1  1  0.000  0.500  0.000  1.0
  C  C2  1  0.484  0.108  0.745  1.0
  C  C3  1  0.516  0.892  0.255  1.0
  C  C4  1  0.729  0.028  0.499  1.0
  C  C5  1  0.892  0.516  0.755  1.0
  C  C6  1  0.271  0.972  0.501  1.0
  C  C7  1  0.108  0.484  0.245  1.0
  C  C8  1  0.107  0.894  0.500  1.0
  C  C9  1  0.972  0.271  0.001  1.0
  C  C10  1  0.893  0.106  0.500  1.0
  C  C11  1  0.028  0.729  0.999  1.0
  C  C12  1  0.106  0.893  1.000  1.0
  C  C13  1  0.894  0.107  0.000  1.0
  O  O14  1  0.470  0.662  0.748  1.0
  O  O15  1  0.530  0.338  0.252  1.0
  O  O16  1  0.957  0.815  0.500  1.0
  O  O17  1  0.338  0.530  0.752  1.0
  O  O18  1  0.043  0.185  0.500  1.0
  O  O19  1  0.662  0.470  0.248  1.0
  O  O20  1  0.375  0.042  0.783  1.0
  O  O21  1  0.185  0.043  1.000  1.0
  O  O22  1  0.625  0.958  0.217  1.0
  O  O23  1  0.815  0.957  0.000  1.0
  O  O24  1  0.958  0.625  0.717  1.0
  O  O25  1  0.042  0.375  0.283  1.0
[/CIF]
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