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Geometry for Na2CO3 (Sodium Carbonate) 1A1 C2V

1910171554
InChI=1S/CH2O3.2Na/c2-1(3)4;;/h(H2,2,3,4);;/q;2*+1/p-2 INChIKey=CDBYLPFSWZWCQE-UHFFFAOYSA-L

CCD/6-31G


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 -0.5969   -0.5969 0.0000 0.0000
O2 0.0000 0.0000 0.8043   0.8043 0.0000 0.0000
O3 0.0000 1.1628 -1.1915   -1.1915 0.0000 1.1628
O4 0.0000 -1.1628 -1.1915   -1.1915 0.0000 -1.1628
Na5 0.0000 2.1882 0.7368   0.7368 0.0000 2.1882
Na6 0.0000 -2.1882 0.7368   0.7368 0.0000 -2.1882
Atom - Atom Distances (Å)
  C1 O2 O3 O4 Na5 Na6
C1 1.4012 1.3060 1.3060 2.5626 2.5626
O2 1.4012 2.3098 2.3098 2.1893 2.1893
O3 1.3060 2.3098 2.3256 2.1840 3.8662
O4 1.3060 2.3098 2.3256 3.8662 2.1840
Na5 2.5626 2.1893 2.1840 3.8662 4.3764
Na6 2.5626 2.1893 3.8662 2.1840 4.3764
Maximum atom distance is 4.3764Å between atoms Na5 and Na6.
picture of Sodium Carbonate
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O2 Na5 88.234 C1 O2 Na6 88.234
C1 O3 Na5 90.920 C1 O4 Na6 90.920
O2 C1 O3 117.083 O2 C1 O4 117.083
O2 Na5 O3 63.764 O2 Na6 O4 63.764
O3 C1 O4 125.835 Na5 O2 Na6 176.468

For information on specific bond angles or dihedrals see the geometry comparison page in section Comparisons > Geometry > Bonds, angles.