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Geometry for CH2OH (Hydroxymethyl radical) 2A C1

1910171554
InChI=1S/CH3O/c1-2/h2H,1H2 INChIKey=CBOIHMRHGLHBPB-UHFFFAOYSA-N

B3LYP/aug-cc-pVTZ


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.6845 0.0276 -0.0570   -0.6860 -0.0088 -0.0429
O2 -0.6696 -0.1258 0.0190   0.6757 -0.0894 0.0034
H3 1.2367 -0.8852 0.0926   -1.1847 -0.9529 0.1004
H4 1.1169 0.9965 0.1479   -1.1659 0.9313 0.1886
H5 -1.1033 0.7299 -0.0505   1.0608 0.7898 -0.0585
Atom - Atom Distances (Å)
  C1 O2 H3 H4 H5
C1 1.3649 1.0772 1.0806 1.9208
O2 1.3649 2.0533 2.1137 0.9619
H3 1.0772 2.0533 1.8863 2.8469
H4 1.0806 2.1137 1.8863 2.2449
H5 1.9208 0.9619 2.8469 2.2449
Maximum atom distance is 2.8469Å between atoms H3 and H5.
picture of Hydroxymethyl radical
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O2 H5 110.079 O2 C1 H3 113.930
O2 C1 H4 119.155 H3 C1 H4 121.892

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