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Geometry for MgCO3 (Magnesium Carbonate) 1A1 C2V

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

MP3/6-31G*


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 -0.7048   -0.7048 0.0000 0.0000
O2 0.0000 0.0000 -1.9096   -1.9096 0.0000 0.0000
Mg3 0.0000 0.0000 1.5380   1.5380 0.0000 0.0000
O4 0.0000 1.1361 0.0656   0.0656 1.1361 0.0000
O5 0.0000 -1.1361 0.0656   0.0656 -1.1361 0.0000
Atom - Atom Distances (Å)
  C1 O2 Mg3 O4 O5
C1 1.2048 2.2428 1.3726 1.3726
O2 1.2048 3.4476 2.2786 2.2786
Mg3 2.2428 3.4476 1.8598 1.8598
O4 1.3726 2.2786 1.8598 2.2721
O5 1.3726 2.2786 1.8598 2.2721
Maximum atom distance is 3.4476Å between atoms O2 and Mg3.
picture of Magnesium Carbonate
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O4 Mg3 86.489 C1 O5 Mg3 86.489
O2 C1 O4 124.140 O2 C1 O5 124.140
O4 C1 O5 111.719 O4 Mg3 O5 75.303

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