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Geometry for CHFClBr (fluorochlorobromomethane) 1A C1

1910171554
InChI=1S/CHBrClF/c2-1(3)4/h1H/t1-/m0/s1 INChIKey=YNKZSBSRKWVMEZ-SFOWXEAESA-N

B2PLYP=FULLultrafine/STO-3G


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.5360 0.5065 0.4124   -0.5322 0.5055 0.4185
Br2 -1.2294 -0.2031 -0.0296   1.2273 -0.2154 -0.0285
Cl3 1.8963 -0.7026 -0.0656   -1.9032 -0.6817 -0.0833
F4 0.7728 1.7122 -0.2055   -0.7542 1.7232 -0.1811
H5 0.6206 0.6023 1.5258   -0.6199 0.5846 1.5330
Atom - Atom Distances (Å)
  C1 Br2 Cl3 F4 H5
C1 1.9533 1.8817 1.3753 1.1207
Br2 1.9533 3.1656 2.7763 2.5477
Cl3 1.8817 3.1656 2.6670 2.4213
F4 1.3753 2.7763 2.6670 2.0622
H5 1.1207 2.5477 2.4213 2.0622
Maximum atom distance is 3.1656Å between atoms Br2 and Cl3.
picture of fluorochlorobromomethane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br2 C1 Cl3 111.250 Br2 C1 F4 111.864
Cl3 C1 F4 108.948
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br2 C1 H5 108.910 Cl3 C1 H5 104.638
F4 C1 H5 111.004

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