National Institute of Standards and Technology
Computational Chemistry Comparison and Benchmark DataBase
Release 22May 2022
NIST Standard Reference Database 101
IIntroduction
IIExperimental data
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XIXIndex of properties
XXH-bond dimers
XXIOddities
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IV.D.4. (XII.A.2.)

Compare Experimental Geometries - experimental data

Species Name
F2SO Thionyl Fluoride
The following table lists the experimentally determined internal coordinates. Coordinate descriptions starting with "r" are bond lengths, starting with "a" are bond angles, and starting with "d" are dihedral angles. Atom numbers are the numbers on the picture of the molecule below to indicate which atoms are invloved in the bond or angle.
Units: bond lengths are in Å, angles are in degrees.
description Value Reference Comment Atom number
rOS 1.413 1972Luc/Smi:327 r0 1 2   
rFS 1.585 1972Luc/Smi:327 r0 1 3   
aFSF 92.8 1972Luc/Smi:327 r0 3 1 4  
aOSF 106.8 1972Luc/Smi:327 r0 2 1 3  

picture of
References
squibreference
1972Luc/Smi:327 NJD Lucas, JG Smith "The microwave spectrum and harmonic force field of thionyl fluoride" J. Mol. Spect. 43, 327-341 (1972)