return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
You are here: Home > Geometry > Calculated > Calculated geometry OR Calculated > Geometry > Calculated geometry

Geometry for BH (Boron monohydride) 1Σ C*V

1910171554
InChI=1S/BH/h1H INChIKey=UWBOAQKPEXKXSU-UHFFFAOYSA-N

mPW1PW91/6-31G


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
B1 0.0000 0.0000 0.2095
H2 0.0000 0.0000 -1.0473
Atom - Atom Distances (Å)
  B1 H2
B1 1.2568
H2 1.2568
Maximum atom distance is 1.2568Å between atoms B1 and H2.
picture of Boron monohydride

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