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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 Br2+ (bromine diatomic cation)
2Πg D*H
1910171554
InChI=1S/Br2/c1-2/q+1 INChIKey=YZABTPRDHYVJNU-UHFFFAOYSA-N
B2PLYP=FULL/aug-cc-pVTZ
Point group is D∞h
| Atom |
Internal |
| x (Å) |
y (Å) |
z (Å) |
| Br1 |
0.0000 |
0.0000 |
1.1065 |
| Br2 |
0.0000 |
0.0000 |
-1.1065 |
Atom - Atom Distances (Å)
| |
Br1 |
Br2 |
| Br1 |
| 2.2130 |
| Br2 |
2.2130 |
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Maximum atom distance is 2.2130Å
between atoms Br1 and Br2.
For information on specific bond angles or dihedrals
see the geometry comparison page in section
Comparisons > Geometry > Bonds, angles.