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Geometry for (Chlorine trifluoride) 1A1 C2V

1910171554
InChI=1S/ClF3/c2-1(3)4 INChIKey=JOHWNGGYGAVMGU-UHFFFAOYSA-N

MP2/aug-cc-pVDZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Cl1 0.0000 0.0000 0.3687   0.0000 0.3687 0.0000
F2 0.0000 0.0000 -1.2791   0.0000 -1.2791 0.0000
F3 0.0000 1.7563 0.2913   1.7563 0.2913 0.0000
F4 0.0000 -1.7563 0.2913   -1.7563 0.2913 0.0000
Atom - Atom Distances (Å)
  Cl1 F2 F3 F4
Cl1 1.6478 1.7580 1.7580
F2 1.6478 2.3560 2.3560
F3 1.7580 2.3560 3.5125
F4 1.7580 2.3560 3.5125
Maximum atom distance is 3.5125Å between atoms F3 and F4.
picture of Chlorine trifluoride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 Cl1 F3 87.477 F2 Cl1 F4 87.477
F3 Cl1 F4 174.955

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