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Geometry for CH2FI (fluoroiodomethane) 1A' CS

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

B3PW91/6-311G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.5197 -1.4952 0.0000   -1.4514 0.6318 0.0000
F2 -0.5899 -2.2726 0.0000   -2.3109 -0.4155 0.0000
I3 0.0000 0.6183 0.0000   0.6165 -0.0470 0.0000
H4 1.0955 -1.6720 0.9058   -1.5839 1.2193 0.9058
H5 1.0955 -1.6720 -0.9058   -1.5839 1.2193 -0.9058
Atom - Atom Distances (Å)
  C1 F2 I3 H4 H5
C1 1.3548 2.1765 1.0877 1.0877
F2 1.3548 2.9505 2.0054 2.0054
I3 2.1765 2.9505 2.6955 2.6955
H4 1.0877 2.0054 2.6955 1.8116
H5 1.0877 2.0054 2.6955 1.8116
Maximum atom distance is 2.9505Å 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 111.201
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 C1 H4 109.894 F2 C1 H5 109.894
I3 C1 H4 106.508 I3 C1 H5 106.508
H4 C1 H5 112.759

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