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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

mPW1PW91/STO-3G


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 -0.0645 -0.8329 0.0336   -0.0653 -0.8334 0.0134
C2 1.3063 -0.4965 0.0225   1.3058 -0.4979 0.0160
C3 -0.9265 0.2738 0.2301   -0.9272 0.2690 0.2328
C4 1.8809 0.7013 -0.1326   1.8819 0.7027 -0.1079
C5 -2.2066 0.2140 -0.1472   -2.2058 0.2192 -0.1511
H6 1.9032 -1.4155 0.1289   1.9016 -1.4197 0.1028
H7 -0.5016 1.1369 0.7656   -0.5040 1.1186 0.7905
H8 2.9684 0.7791 -0.1237   2.9695 0.7794 -0.0928
H9 1.3196 1.6239 -0.2782   1.3218 1.6291 -0.2338
H10 -2.8879 1.0360 0.0765   -2.8874 1.0362 0.0893
H11 -2.6101 -0.6523 -0.6750   -2.6078 -0.6339 -0.7012
Atom - Atom Distances (Å)
  O1 C2 C3 C4 C5 H6 H7 H8 H9 H10 H11
O1 1.4115 1.4165 2.4832 2.3911 2.0543 2.1464 3.4383 2.8371 3.3861 2.6486
C2 1.4115 2.3710 1.3375 3.5880 1.1010 2.5473 2.1003 2.1417 4.4657 3.9811
C3 1.4165 2.3710 2.8628 1.3359 3.2971 1.1010 3.9434 2.6694 2.1099 2.1241
C4 2.4832 1.3375 2.8628 4.1165 2.1330 2.5832 1.0903 1.0898 4.7851 4.7219
C5 2.3911 3.5880 1.3359 4.1165 4.4296 2.1429 5.2059 3.7999 1.0908 1.0917
H6 2.0543 1.1010 3.2971 2.1330 4.4296 3.5642 2.4525 3.1216 5.3821 4.6474
H7 2.1464 2.5473 1.1010 2.5832 2.1429 3.5642 3.6000 2.1548 2.4858 3.1181
H8 3.4383 2.1003 3.9434 1.0903 5.2059 2.4525 3.6000 1.8591 5.8654 5.7856
H9 2.8371 2.1417 2.6694 1.0898 3.7999 3.1216 2.1548 1.8591 4.2631 4.5587
H10 3.3861 4.4657 2.1099 4.7851 1.0908 5.3821 2.4858 5.8654 4.2631 1.8688
H11 2.6486 3.9811 2.1241 4.7219 1.0917 4.6474 3.1181 5.7856 4.5587 1.8688
Maximum atom distance is 5.8654Å 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 129.169 O1 C3 C5 120.591
C2 O1 C3 113.942
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O1 C2 H6 109.072 O1 C3 H7 116.436
C2 C4 H8 119.440 C2 C4 H9 123.529
C3 C5 H10 120.451 C3 C5 H11 121.754
C4 C2 H6 121.722 C5 C3 H7 122.835
H8 C4 H9 117.029 H10 C5 H11 117.792

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