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Geometry for CH2CHCH2F (Allyl Fluoride) 1A' CS cis

1910171554
InChI=1S/C3H5F/c1-2-3-4/h2H,1,3H2 INChIKey=QCMKXHXKNIOBBC-UHFFFAOYSA-N

HF/6-31G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.9398 -0.2190 0.0000   -0.7161 -0.6469 0.0000
C2 0.0000 0.9473 0.0000   0.7779 -0.5405 0.0000
C3 1.3130 0.8546 0.0000   1.4511 0.5906 0.0000
F4 -0.2610 -1.4052 0.0000   -1.3029 0.5875 0.0000
H5 1.9328 1.7329 0.0000   2.5260 0.5985 0.0000
H6 1.8108 -0.0969 0.0000   0.9537 1.5424 0.0000
H7 -0.4814 1.9124 0.0000   1.2958 -1.4866 0.0000
H8 -1.5762 -0.1996 0.8778   -1.0633 -1.1805 0.8778
H9 -1.5762 -0.1996 -0.8778   -1.0633 -1.1805 -0.8778
Atom - Atom Distances (Å)
  C1 C2 C3 F4 H5 H6 H7 H8 H9
C1 1.4978 2.4956 1.3667 3.4730 2.7533 2.1801 1.0844 1.0844
C2 1.4978 1.3163 2.3669 2.0864 2.0903 1.0786 2.1378 2.1378
C3 2.4956 1.3163 2.7540 1.0749 1.0739 2.0830 3.1984 3.1984
F4 1.3667 2.3669 2.7540 3.8289 2.4503 3.3249 1.9884 1.9884
H5 3.4730 2.0864 1.0749 3.8289 1.8339 2.4209 4.1010 4.1010
H6 2.7533 2.0903 1.0739 2.4503 1.8339 3.0482 3.5004 3.5004
H7 2.1801 1.0786 2.0830 3.3249 2.4209 3.0482 2.5357 2.5357
H8 1.0844 2.1378 3.1984 1.9884 4.1010 3.5004 2.5357 1.7556
H9 1.0844 2.1378 3.1984 1.9884 4.1010 3.5004 2.5357 1.7556
Maximum atom distance is 4.1010Å between atoms H5 and H8.
picture of Allyl Fluoride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 C3 124.830 C2 C1 F4 111.355
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H7 114.626 C2 C1 H8 110.752
C2 C1 H9 110.752 C2 C3 H5 121.175
C2 C3 H6 121.648 C3 C2 H7 120.544
F4 C1 H8 107.875 F4 C1 H9 107.875
H5 C3 H6 117.177

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