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Geometry for C2H4O (Ethylene oxide) 1A1 C2V

1910171554
InChI=1S/C2H4O/c1-2-3-1/h1-2H2 INChIKey=IAYPIBMASNFSPL-UHFFFAOYSA-N

MP2=FULL/3-21G


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 0.0000 0.0000 0.9224   0.0000 0.9224 0.0000
C2 0.0000 0.7465 -0.4039   0.7465 -0.4039 0.0000
C3 0.0000 -0.7465 -0.4039   -0.7465 -0.4039 0.0000
H4 0.9195 1.2731 -0.6329   1.2731 -0.6329 0.9195
H5 -0.9195 1.2731 -0.6329   1.2731 -0.6329 -0.9195
H6 -0.9195 -1.2731 -0.6329   -1.2731 -0.6329 -0.9195
H7 0.9195 -1.2731 -0.6329   -1.2731 -0.6329 0.9195
Atom - Atom Distances (Å)
  O1 C2 C3 H4 H5 H6 H7
O1 1.5219 1.5219 2.2103 2.2103 2.2103 2.2103
C2 1.5219 1.4930 1.0841 1.0841 2.2309 2.2309
C3 1.5219 1.4930 2.2309 2.2309 1.0841 1.0841
H4 2.2103 1.0841 2.2309 1.8390 3.1410 2.5463
H5 2.2103 1.0841 2.2309 1.8390 2.5463 3.1410
H6 2.2103 2.2309 1.0841 3.1410 2.5463 1.8390
H7 2.2103 2.2309 1.0841 2.5463 3.1410 1.8390
Maximum atom distance is 3.1410Å between atoms H4 and H6.
picture of Ethylene oxide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O1 C2 C3 60.627 O1 C3 C2 60.627
C2 O1 C3 58.745
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O1 C2 H4 114.983 O1 C2 H5 114.983
O1 C3 H6 114.983 O1 C3 H7 114.983
C2 C3 H6 119.063 C2 C3 H7 119.063
C3 C2 H4 119.063 C3 C2 H5 119.063
H4 C2 H5 116.028 H6 C3 H7 116.028

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