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Geometry for CH2CHOCHCH2 (Vinyl ether) 1A C1

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

MP2=FULL/6-31+G**


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 -0.0390 -0.8302 0.0561   0.0371 -0.8279 -0.0846
C2 1.2895 -0.4880 -0.0151   -1.2909 -0.4844 -0.0085
C3 -0.9226 0.1892 0.3472   0.9250 0.1984 -0.3356
C4 1.7912 0.7468 -0.1482   -1.7899 0.7465 0.1646
C5 -2.1256 0.2390 -0.2271   2.1250 0.2248 0.2464
H6 1.9047 -1.3743 0.0345   -1.9082 -1.3667 -0.0921
H7 -0.5804 0.8835 1.1061   0.5887 0.9196 -1.0717
H8 2.8618 0.8649 -0.1847   -2.8604 0.8663 0.1996
H9 1.1745 1.6258 -0.2427   -1.1713 1.6199 0.2927
H10 -2.8309 0.9931 0.0823   2.8340 0.9871 -0.0330
H11 -2.4120 -0.4736 -0.9846   2.4054 -0.5145 0.9802
Atom - Atom Distances (Å)
  O1 C2 C3 C4 C5 H6 H7 H8 H9 H10 H11
O1 1.3738 1.3801 2.4245 2.3616 2.0186 2.0814 3.3684 2.7557 3.3346 2.6155
C2 1.3738 2.3417 1.3394 3.4981 1.0800 2.5758 2.0811 2.1291 4.3796 3.8264
C3 1.3801 2.3417 2.8144 1.3340 3.2459 1.0840 3.8809 2.6096 2.0876 2.1050
C4 2.4245 1.3394 2.8144 3.9504 2.1320 2.6862 1.0778 1.0779 4.6344 4.4559
C5 2.3616 3.4981 1.3340 3.9504 4.3491 2.1402 5.0267 3.5797 1.0779 1.0787
H6 2.0186 1.0800 3.2459 2.1320 4.3491 3.5244 2.4451 3.1002 5.2946 4.5258
H7 2.0814 2.5758 1.0840 2.6862 2.1402 3.5244 3.6763 2.3345 2.4749 3.0931
H8 3.3684 2.0811 3.8809 1.0778 5.0267 2.4451 3.6763 1.8519 5.7004 5.4995
H9 2.7557 2.1291 2.6096 1.0779 3.5797 3.1002 2.3345 1.8519 4.0681 4.2215
H10 3.3346 4.3796 2.0876 4.6344 1.0779 5.2946 2.4749 5.7004 4.0681 1.8614
H11 2.6155 3.8264 2.1050 4.4559 1.0787 4.5258 3.0931 5.4995 4.2215 1.8614
Maximum atom distance is 5.7004Å 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 126.654 O1 C3 C5 120.939
C2 O1 C3 116.493
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O1 C2 H6 110.119 O1 C3 H7 114.750
C2 C4 H8 118.449 C2 C4 H9 123.109
C3 C5 H10 119.513 C3 C5 H11 121.136
C4 C2 H6 123.219 C5 C3 H7 124.207
H8 C4 H9 118.427 H10 C5 H11 119.342

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