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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

B2PLYP/6-31G*


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 0.0000 0.0000 0.3316   0.3316 0.0000 0.0000
C2 0.0000 1.1741 -0.3753   -0.3753 0.0000 1.1741
C3 0.0000 -1.1741 -0.3753   -0.3753 0.0000 -1.1741
C4 0.0000 2.3566 0.2363   0.2363 0.0000 2.3566
C5 0.0000 -2.3566 0.2363   0.2363 0.0000 -2.3566
H6 0.0000 1.0630 -1.4572   -1.4572 0.0000 1.0630
H7 0.0000 -1.0630 -1.4572   -1.4572 0.0000 -1.0630
H8 0.0000 3.2643 -0.3513   -0.3513 0.0000 3.2643
H9 0.0000 2.4340 1.3162   1.3162 0.0000 2.4340
H10 0.0000 -3.2643 -0.3513   -0.3513 0.0000 -3.2643
H11 0.0000 -2.4340 1.3162   1.3162 0.0000 -2.4340
Atom - Atom Distances (Å)
  O1 C2 C3 C4 C5 H6 H7 H8 H9 H10 H11
O1 1.3705 1.3705 2.3586 2.3586 2.0809 2.0809 3.3350 2.6255 3.3350 2.6255
C2 1.3705 2.3481 1.3314 3.5833 1.0876 2.4850 2.0904 2.1091 4.4384 3.9848
C3 1.3705 2.3481 3.5833 1.3314 2.4850 1.0876 4.4384 3.9848 2.0904 2.1091
C4 2.3586 1.3314 3.5833 4.7133 2.1311 3.8161 1.0813 1.0826 5.6515 4.9108
C5 2.3586 3.5833 1.3314 4.7133 3.8161 2.1311 5.6515 4.9108 1.0813 1.0826
H6 2.0809 1.0876 2.4850 2.1311 3.8161 2.1261 2.4634 3.0937 4.4664 4.4633
H7 2.0809 2.4850 1.0876 3.8161 2.1311 2.1261 4.4664 4.4633 2.4634 3.0937
H8 3.3350 2.0904 4.4384 1.0813 5.6515 2.4634 4.4664 1.8628 6.5286 5.9372
H9 2.6255 2.1091 3.9848 1.0826 4.9108 3.0937 4.4633 1.8628 5.9372 4.8679
H10 3.3350 4.4384 2.0904 5.6515 1.0813 4.4664 2.4634 6.5286 5.9372 1.8628
H11 2.6255 3.9848 2.1091 4.9108 1.0826 4.4633 3.0937 5.9372 4.8679 1.8628
Maximum atom distance is 6.5286Å 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 121.596 O1 C3 C5 121.596
C2 O1 C3 117.891
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O1 C2 H6 115.195 O1 C3 H7 115.195
C2 C4 H8 119.731 C2 C4 H9 121.445
C3 C5 H10 119.731 C3 C5 H11 121.445
C4 C2 H6 123.208 C5 C3 H7 123.208
H8 C4 H9 118.824 H10 C5 H11 118.824

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