The crystal structure described by NaCo(CO)4 crystallizes in the orthorhombic Pbcm space group. Na(1) is bonded in a 4-coordinate geometry to one O(1), one O(2), and two equivalent O(3) atoms. Co(1) is bonded in a tetrahedral geometry to one C(2), one C(3), and two equivalent C(1) atoms. There are three inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one Co(1) and one O(3) atom. In the second C site, C(2) is bonded in a linear geometry to one Co(1) and one O(1) atom. In the third C site, C(3) is bonded in a distorted linear geometry to one Co(1) and one O(2) atom. There are three inequivalent O sites. In the first O site, O(1) is bonded in a linear geometry to one Na(1) and one C(2) atom. In the second O site, O(2) is bonded in a distorted linear geometry to one Na(1) and one C(3) atom. In the third O site, O(3) is bonded in a bent 150 degrees geometry to one Na(1) and one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaCo(CO)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.641
_cell_length_b   9.319
_cell_length_c   13.935
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   732.464
_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
  Na  Na0  1  0.413  0.250  0.084  1.0
  Na  Na1  1  0.587  0.250  0.584  1.0
  Na  Na2  1  0.413  0.750  0.416  1.0
  Na  Na3  1  0.587  0.750  0.916  1.0
  Co  Co4  1  0.812  0.250  0.377  1.0
  Co  Co5  1  0.188  0.250  0.877  1.0
  Co  Co6  1  0.812  0.750  0.123  1.0
  Co  Co7  1  0.188  0.750  0.623  1.0
  C  C8  1  0.637  0.904  0.123  1.0
  C  C9  1  0.988  0.750  0.225  1.0
  C  C10  1  0.363  0.904  0.623  1.0
  C  C11  1  0.970  0.750  0.534  1.0
  C  C12  1  0.637  0.096  0.377  1.0
  C  C13  1  0.012  0.750  0.725  1.0
  C  C14  1  0.363  0.404  0.877  1.0
  C  C15  1  0.363  0.096  0.877  1.0
  C  C16  1  0.363  0.596  0.623  1.0
  C  C17  1  0.637  0.596  0.123  1.0
  C  C18  1  0.637  0.404  0.377  1.0
  C  C19  1  0.970  0.250  0.966  1.0
  C  C20  1  0.988  0.250  0.275  1.0
  C  C21  1  0.012  0.250  0.775  1.0
  C  C22  1  0.030  0.250  0.466  1.0
  C  C23  1  0.030  0.750  0.034  1.0
  O  O24  1  0.116  0.250  0.209  1.0
  O  O25  1  0.192  0.750  0.981  1.0
  O  O26  1  0.521  0.991  0.374  1.0
  O  O27  1  0.479  0.991  0.874  1.0
  O  O28  1  0.884  0.250  0.709  1.0
  O  O29  1  0.521  0.009  0.126  1.0
  O  O30  1  0.808  0.750  0.481  1.0
  O  O31  1  0.521  0.509  0.374  1.0
  O  O32  1  0.808  0.250  0.019  1.0
  O  O33  1  0.521  0.491  0.126  1.0
  O  O34  1  0.479  0.009  0.626  1.0
  O  O35  1  0.192  0.250  0.519  1.0
  O  O36  1  0.479  0.509  0.874  1.0
  O  O37  1  0.116  0.750  0.291  1.0
  O  O38  1  0.479  0.491  0.626  1.0
  O  O39  1  0.884  0.750  0.791  1.0
[/CIF]
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The crystal structure described by NaCo(CO)4 crystallizes in the orthorhombic Pbcm space group. Na(1) is bonded in a 4-coordinate geometry to one O(1), one O(2), and two equivalent O(3) atoms. Co(1) is bonded in a tetrahedral geometry to one C(2), one C(3), and two equivalent C(1) atoms. There are three inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one Co(1) and one O(3) atom. In the second C site, C(2) is bonded in a linear geometry to one Co(1) and one O(1) atom. In the third C site, C(3) is bonded in a distorted linear geometry to one Co(1) and one O(2) atom. There are three inequivalent O sites. In the first O site, O(1) is bonded in a linear geometry to one Na(1) and one C(2) atom. In the second O site, O(2) is bonded in a distorted linear geometry to one Na(1) and one C(3) atom. In the third O site, O(3) is bonded in a bent 150 degrees geometry to one Na(1) and one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaCo(CO)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.641
_cell_length_b   9.319
_cell_length_c   13.935
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   732.464
_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
  Na  Na0  1  0.413  0.250  0.084  1.0
  Na  Na1  1  0.587  0.250  0.584  1.0
  Na  Na2  1  0.413  0.750  0.416  1.0
  Na  Na3  1  0.587  0.750  0.916  1.0
  Co  Co4  1  0.812  0.250  0.377  1.0
  Co  Co5  1  0.188  0.250  0.877  1.0
  Co  Co6  1  0.812  0.750  0.123  1.0
  Co  Co7  1  0.188  0.750  0.623  1.0
  C  C8  1  0.637  0.904  0.123  1.0
  C  C9  1  0.988  0.750  0.225  1.0
  C  C10  1  0.363  0.904  0.623  1.0
  C  C11  1  0.970  0.750  0.534  1.0
  C  C12  1  0.637  0.096  0.377  1.0
  C  C13  1  0.012  0.750  0.725  1.0
  C  C14  1  0.363  0.404  0.877  1.0
  C  C15  1  0.363  0.096  0.877  1.0
  C  C16  1  0.363  0.596  0.623  1.0
  C  C17  1  0.637  0.596  0.123  1.0
  C  C18  1  0.637  0.404  0.377  1.0
  C  C19  1  0.970  0.250  0.966  1.0
  C  C20  1  0.988  0.250  0.275  1.0
  C  C21  1  0.012  0.250  0.775  1.0
  C  C22  1  0.030  0.250  0.466  1.0
  C  C23  1  0.030  0.750  0.034  1.0
  O  O24  1  0.116  0.250  0.209  1.0
  O  O25  1  0.192  0.750  0.981  1.0
  O  O26  1  0.521  0.991  0.374  1.0
  O  O27  1  0.479  0.991  0.874  1.0
  O  O28  1  0.884  0.250  0.709  1.0
  O  O29  1  0.521  0.009  0.126  1.0
  O  O30  1  0.808  0.750  0.481  1.0
  O  O31  1  0.521  0.509  0.374  1.0
  O  O32  1  0.808  0.250  0.019  1.0
  O  O33  1  0.521  0.491  0.126  1.0
  O  O34  1  0.479  0.009  0.626  1.0
  O  O35  1  0.192  0.250  0.519  1.0
  O  O36  1  0.479  0.509  0.874  1.0
  O  O37  1  0.116  0.750  0.291  1.0
  O  O38  1  0.479  0.491  0.626  1.0
  O  O39  1  0.884  0.750  0.791  1.0
[/CIF]
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