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Geometry for CH2CHOCHCH2 (Vinyl ether) 1A1 C2V

1910171554
InChI=1S/C4H6O/c1-3-5-4-2/h3-4H,1-2H2 INChIKey=QYKIQEUNHZKYBP-UHFFFAOYSA-N

mPW1PW91/6-31G(2df,p)


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 0.0000 0.0000 0.3303   0.3303 0.0000 0.0000
C2 0.0000 1.1624 -0.3670   -0.3670 0.0000 1.1624
C3 0.0000 -1.1624 -0.3670   -0.3670 0.0000 -1.1624
C4 0.0000 2.3439 0.2310   0.2310 0.0000 2.3439
C5 0.0000 -2.3439 0.2310   0.2310 0.0000 -2.3439
H6 0.0000 1.0495 -1.4489   -1.4489 0.0000 1.0495
H7 0.0000 -1.0495 -1.4489   -1.4489 0.0000 -1.0495
H8 0.0000 3.2443 -0.3659   -0.3659 0.0000 3.2443
H9 0.0000 2.4335 1.3092   1.3092 0.0000 2.4335
H10 0.0000 -3.2443 -0.3659   -0.3659 0.0000 -3.2443
H11 0.0000 -2.4335 1.3092   1.3092 0.0000 -2.4335
Atom - Atom Distances (Å)
  O1 C2 C3 C4 C5 H6 H7 H8 H9 H10 H11
O1 1.3555 1.3555 2.3460 2.3460 2.0657 2.0657 3.3182 2.6230 3.3182 2.6230
C2 1.3555 2.3248 1.3243 3.5569 1.0879 2.4623 2.0819 2.1036 4.4067 3.9674
C3 1.3555 2.3248 3.5569 1.3243 2.4623 1.0879 4.4067 3.9674 2.0819 2.1036
C4 2.3460 1.3243 3.5569 4.6878 2.1208 3.7865 1.0803 1.0819 5.6200 4.8976
C5 2.3460 3.5569 1.3243 4.6878 3.7865 2.1208 5.6200 4.8976 1.0803 1.0819
H6 2.0657 1.0879 2.4623 2.1208 3.7865 2.0989 2.4476 3.0859 4.4283 4.4428
H7 2.0657 2.4623 1.0879 3.7865 2.1208 2.0989 4.4283 4.4428 2.4476 3.0859
H8 3.3182 2.0819 4.4067 1.0803 5.6200 2.4476 4.4283 1.8610 6.4887 5.9198
H9 2.6230 2.1036 3.9674 1.0819 4.8976 3.0859 4.4428 1.8610 5.9198 4.8671
H10 3.3182 4.4067 2.0819 5.6200 1.0803 4.4283 2.4476 6.4887 5.9198 1.8610
H11 2.6230 3.9674 2.1036 4.8976 1.0819 4.4428 3.0859 5.9198 4.8671 1.8610
Maximum atom distance is 6.4887Å between atoms H8 and H10.
picture of Vinyl ether
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O1 C2 C4 122.198 O1 C3 C5 122.198
C2 O1 C3 118.086
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O1 C2 H6 114.998 O1 C3 H7 114.998
C2 C4 H8 119.613 C2 C4 H9 121.596
C3 C5 H10 119.613 C3 C5 H11 121.596
C4 C2 H6 122.804 C5 C3 H7 122.804
H8 C4 H9 118.791 H10 C5 H11 118.791

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