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Geometry for CH3O (Methoxy radical) 2A' C1

1910171554
InChI=1S/CH3O/c1-2/h1H3 INChIKey=GRVDJDISBSALJP-UHFFFAOYSA-N

B97D3/aug-cc-pVTZ


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.5702 0.0001 -0.0166   -0.5703 0.0001 -0.0156
O2 0.7900 0.0000 -0.0072   0.7900 0.0000 -0.0086
H3 -0.8730 -0.0035 1.0571   -0.8712 -0.0036 1.0586
H4 -1.0131 0.9168 -0.4473   -1.0139 0.9168 -0.4455
H5 -1.0128 -0.9143 -0.4526   -1.0136 -0.9142 -0.4509
Atom - Atom Distances (Å)
  C1 O2 H3 H4 H5
C1 1.3603 1.1156 1.1054 1.1055
O2 1.3603 1.9745 2.0701 2.0699
H3 1.1156 1.9745 1.7692 1.7687
H4 1.1054 2.0701 1.7692 1.8311
H5 1.1055 2.0699 1.7687 1.8311
Maximum atom distance is 2.0701Å between atoms O2 and H4.
picture of Methoxy 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
O2 C1 H3 105.352 O2 C1 H4 113.789
O2 C1 H5 113.767 H3 C1 H4 105.602
H3 C1 H5 105.561 H4 C1 H5 111.831

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