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Geometry for BeCO3 (Beryllium Carbonate) 1A1 C2V

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

MP2=FULL/cc-pVDZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.3366   0.3366 0.0000 0.0000
O2 0.0000 0.0000 1.5301   1.5301 0.0000 0.0000
Be3 0.0000 0.0000 -1.5015   -1.5015 0.0000 0.0000
O4 0.0000 1.1219 -0.5159   -0.5159 1.1219 0.0000
O5 0.0000 -1.1219 -0.5159   -0.5159 -1.1219 0.0000
Atom - Atom Distances (Å)
  C1 O2 Be3 O4 O5
C1 1.1935 1.8381 1.4090 1.4090
O2 1.1935 3.0316 2.3335 2.3335
Be3 1.8381 3.0316 1.4933 1.4933
O4 1.4090 2.3335 1.4933 2.2437
O5 1.4090 2.3335 1.4933 2.2437
Maximum atom distance is 3.0316Å between atoms O2 and Be3.
picture of Beryllium Carbonate
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O4 Be3 78.531 C1 O5 Be3 78.531
O2 C1 O4 127.232 O2 C1 O5 127.232
O4 C1 O5 105.535 O4 Be3 O5 97.402

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