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Geometry for CH2FI (fluoroiodomethane) 1A' CS

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

MP2/6-311G**


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.5227 -1.4812 0.0000   -1.5171 0.4070 0.0000
F2 -0.5929 -2.2626 0.0000   -2.2102 -0.7655 0.0000
I3 0.0000 0.6147 0.0000   0.6129 0.0474 0.0000
H4 1.1000 -1.6638 0.9039   -1.7436 0.9685 0.9039
H5 1.1000 -1.6638 -0.9039   -1.7436 0.9685 -0.9039
Atom - Atom Distances (Å)
  C1 F2 I3 H4 H5
C1 1.3620 2.1601 1.0879 1.0879
F2 1.3620 2.9377 2.0103 2.0103
I3 2.1601 2.9377 2.6867 2.6867
H4 1.0879 2.0103 2.6867 1.8078
H5 1.0879 2.0103 2.6867 1.8078
Maximum atom distance is 2.9377Å 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 111.004
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 C1 H4 109.774 F2 C1 H5 109.774
I3 C1 H4 106.935 I3 C1 H5 106.935
H4 C1 H5 112.364

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