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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 GeS2 (Germanium disulfide)
1Σg D*H
1910171554
InChI=1S/GeS2/c2-1-3 INChIKey=YIZVROFXIVWAAZ-UHFFFAOYSA-N
CCD/TZVP
Point group is D∞h
| Atom |
Internal |
| x (Å) |
y (Å) |
z (Å) |
| Ge1 |
0.0000 |
0.0000 |
0.0000 |
| S2 |
0.0000 |
0.0000 |
2.0040 |
| S3 |
0.0000 |
0.0000 |
-2.0040 |
Atom - Atom Distances (Å)
| |
Ge1 |
S2 |
S3 |
| Ge1 |
| 2.0040 |
2.0040 |
| S2 |
2.0040 |
| 4.0080 |
| S3 |
2.0040 |
4.0080 |
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Maximum atom distance is 4.0080Å
between atoms S2 and S3.
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
| atom1 |
atom2 |
atom3 |
angle |
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atom1 |
atom2 |
atom3 |
angle |
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S2 |
Ge1 |
S3 |
180.000 |
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For information on specific bond angles or dihedrals
see the geometry comparison page in section
Comparisons > Geometry > Bonds, angles.