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Geometry for CH2FI (fluoroiodomethane) 1A' CS

1910171554
InChI=1S/CH2FI/c2-1-3/h1H2 INChIKey=XGVXNTVBGYLJIR-UHFFFAOYSA-N

MP2/LANL2DZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.5659 -1.4844 0.0000   -1.4332 0.6852 0.0000
F2 -0.6269 -2.3271 0.0000   -2.3705 -0.4348 0.0000
I3 0.0000 0.6275 0.0000   0.6254 -0.0512 0.0000
H4 1.1233 -1.7044 0.9168   -1.6070 1.2587 0.9168
H5 1.1233 -1.7044 -0.9168   -1.6070 1.2587 -0.9168
Atom - Atom Distances (Å)
  C1 F2 I3 H4 H5
C1 1.4605 2.1864 1.0952 1.0952
F2 1.4605 3.0204 2.0715 2.0715
I3 2.1864 3.0204 2.7459 2.7459
H4 1.0952 2.0715 2.7459 1.8335
H5 1.0952 2.0715 2.7459 1.8335
Maximum atom distance is 3.0204Å between atoms F2 and I3.
picture of fluoroiodomethane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 C1 I3 110.239
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 C1 H4 107.440 F2 C1 H5 107.440
I3 C1 H4 109.014 I3 C1 H5 109.014
H4 C1 H5 113.660

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