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Computational Chemistry Comparison and Benchmark DataBase
Release 22 (May 2022) Standard Reference Database 101
National Institute of Standards and Technology
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Geometry for Na2O (disodium monoxide)
1A1 C2V
1910171554
InChI=1S/2Na.O INChIKey=QVUYWFOHKOTLOB-UHFFFAOYNA-N
mPW1PW91/aug-cc-pVDZ
Point group is C2v
| Atom |
Internal |
| x (Å) |
y (Å) |
z (Å) |
| O1 |
0.0000 |
0.0000 |
0.1746 |
| Na2 |
0.0000 |
1.9783 |
-0.0635 |
| Na3 |
0.0000 |
-1.9783 |
-0.0635 |
Atom - Atom Distances (Å)
| |
O1 |
Na2 |
Na3 |
| O1 |
| 1.9925 |
1.9925 |
| Na2 |
1.9925 |
| 3.9565 |
| Na3 |
1.9925 |
3.9565 |
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Maximum atom distance is 3.9565Å
between atoms Na2 and Na3.
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
| atom1 |
atom2 |
atom3 |
angle |
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atom1 |
atom2 |
atom3 |
angle |
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Na2 |
O1 |
Na3 |
166.276 |
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For information on specific bond angles or dihedrals
see the geometry comparison page in section
Comparisons > Geometry > Bonds, angles.