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II.A.3. (XII.A.1.)

Listing of experimental geometry data for HOF (Hypofluorous acid)

Rotational Constants (cm-1)
See section I.F.4 to change rotational constant units
A B C
19.64720 0.90036 0.86092
Rotational Constants from 1988Hal/Ha:4885
Calculated rotational constants for HOF (Hypofluorous acid).

Point Group Cs

Internal coordinates (distances (r) in Å) (angles (a) in degrees) (dihedrals (d) in degrees)
Description Value Connectivity Reference Comment
Atom 1 Atom 2 Atom 3 Atom 4
rOH 0.960 1 2 Gurvich
rFO 1.442 1 3 Gurvich
aHOF 97.2 2 1 3
picture of Hypofluorous acid

Bond descriptions
Examples: C-C single bond, C=C, double bond, C#C triple bond, C:C aromatic bond
Bond Type Count
H-O 1
O-F 1

Atom x (Å) y (Å) z (Å)
O1 0.0529 0.7143 0.0000
H2 -0.8995 0.8346 0.0000
F3 0.0529 -0.7277 0.0000

Atom - Atom Distances (Å)
  O1 H2 F3
O10.96001.4420
H20.96001.8297
F31.44201.8297

Calculated geometries for HOF (Hypofluorous acid).


References
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squib reference DOI
1988Hal/Ha:4885 Halonen, L.; Ha, T. "Equilibrium strcuture and anharmonic foce field of hypofluorous acid, HOF." Journal of Chemical Physics. 89, 4885-4888 (1988) 10.1063/1.455658
Gurvich Gurvich, L.V.; Veyts, I. V.; Alcock, C. B., Thermodynamic Properties of Individual Substances, Fouth Edition, Hemisphere Pub. Co., New York, 1989 10.1351/pac198961061027

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