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Geometry for BH3CO (Borane carbonyl) 1A1 C3V

1910171554
InChI=1S/CH3BO/c2-1-3/h2H3 INChIKey=ZJUVLBOEAXFSHP-UHFFFAOYSA-N

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Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
B1 0.0000 0.0000 -1.3463   0.0000 -1.3463 0.0000
C2 0.0000 0.0000 0.1848   0.0000 0.1848 0.0000
O3 0.0000 0.0000 1.3204   0.0000 1.3204 0.0000
H4 0.0000 1.1715 -1.6468   1.1715 -1.6468 0.0000
H5 1.0146 -0.5858 -1.6468   -0.5858 -1.6468 1.0146
H6 -1.0146 -0.5858 -1.6468   -0.5858 -1.6468 -1.0146
Atom - Atom Distances (Å)
  B1 C2 O3 H4 H5 H6
B1 1.5310 2.6667 1.2095 1.2095 1.2095
C2 1.5310 1.1357 2.1742 2.1742 2.1742
O3 2.6667 1.1357 3.1902 3.1902 3.1902
H4 1.2095 2.1742 3.1902 2.0292 2.0292
H5 1.2095 2.1742 3.1902 2.0292 2.0292
H6 1.2095 2.1742 3.1902 2.0292 2.0292
Maximum atom distance is 3.1902Å between atoms O3 and H5.
picture of Borane carbonyl
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
B1 C2 O3 180.000
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C2 B1 H4 104.389 C2 B1 H5 104.389
C2 B1 H6 104.389 H4 B1 H5 114.039
H4 B1 H6 114.039 H5 B1 H6 114.039

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