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Geometry for C2H6O2 (1,2-Ethanediol) 1Ag C2H

1910171554
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2 INChIKey=LYCAIKOWRPUZTN-UHFFFAOYSA-N

HF/6-31G


Point group is C2h
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.7537 0.0000   0.5416 0.5242 0.0000
C2 0.0000 -0.7537 0.0000   -0.5416 -0.5242 0.0000
O3 1.3769 -1.1508 0.0000   -1.7845 0.1891 0.0000
O4 -1.3769 1.1508 0.0000   1.7845 -0.1891 0.0000
H5 1.5078 -2.0913 0.0000   -2.5513 -0.3710 0.0000
H6 -1.5078 2.0913 0.0000   2.5513 0.3710 0.0000
H7 -0.5137 -1.1201 0.8795   -0.4476 -1.1481 0.8795
H8 -0.5137 -1.1201 -0.8795   -0.4476 -1.1481 -0.8795
H9 0.5137 1.1201 0.8795   0.4476 1.1481 0.8795
H10 0.5137 1.1201 -0.8795   0.4476 1.1481 -0.8795
Atom - Atom Distances (Å)
  C1 C2 O3 O4 H5 H6 H7 H8 H9 H10
C1 1.5075 2.3501 1.4330 3.2199 2.0156 2.1328 2.1328 1.0824 1.0824
C2 1.5075 1.4330 2.3501 2.0156 3.2199 1.0824 1.0824 2.1328 2.1328
O3 2.3501 1.4330 3.5890 0.9496 4.3397 2.0854 2.0854 2.5837 2.5837
O4 1.4330 2.3501 3.5890 4.3397 0.9496 2.5837 2.5837 2.0854 2.0854
H5 3.2199 2.0156 0.9496 4.3397 5.1564 2.4090 2.4090 3.4749 3.4749
H6 2.0156 3.2199 4.3397 0.9496 5.1564 3.4749 3.4749 2.4090 2.4090
H7 2.1328 1.0824 2.0854 2.5837 2.4090 3.4749 1.7590 2.4646 3.0279
H8 2.1328 1.0824 2.0854 2.5837 2.4090 3.4749 1.7590 3.0279 2.4646
H9 1.0824 2.1328 2.5837 2.0854 3.4749 2.4090 2.4646 3.0279 1.7590
H10 1.0824 2.1328 2.5837 2.0854 3.4749 2.4090 3.0279 2.4646 1.7590
Maximum atom distance is 5.1564Å between atoms H5 and H6.
picture of 1,2-Ethanediol
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 O3 106.087 C2 C1 O4 106.087
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H7 109.784 C1 C2 H8 109.784
C1 O4 H6 114.009 C2 C1 H9 109.784
C2 C1 H10 109.784 C2 O3 H5 114.009
O3 C2 H7 111.236 O3 C2 H8 111.236
O4 C1 H9 111.236 O4 C1 H10 111.236
H7 C2 H8 108.689 H9 C1 H10 108.689

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