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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 Si2 (Silicon diatomic)
3Σg D*H
1910171554
InChI=1S/Si2/c1-2 INChIKey=NTQGILPNLZZOJH-UHFFFAOYSA-N
MP2/6-311G*
Point group is D∞h
| Atom |
Internal |
| x (Å) |
y (Å) |
z (Å) |
| Si1 |
0.0000 |
0.0000 |
1.1153 |
| Si2 |
0.0000 |
0.0000 |
-1.1153 |
Atom - Atom Distances (Å)
| |
Si1 |
Si2 |
| Si1 |
| 2.2307 |
| Si2 |
2.2307 |
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Maximum atom distance is 2.2307Å
between atoms Si1 and Si2.
For information on specific bond angles or dihedrals
see the geometry comparison page in section
Comparisons > Geometry > Bonds, angles.