National Institute of Standards and Technology

Computational Chemistry Comparison and Benchmark DataBase
Release 22	May 2022
NIST Standard Reference Database 101

I	Introduction
II	Experimental data
III	Calculated data
IV	Data comparisons
V	Cost comparisons
VI	Input and output files
VII	Tutorials and Units
VIII	Links to other sites
IX	Feedback
X	Older CCCBDB versions
XII	Geometries
XIII	Vibrations
XIV	Reaction data
XV	Entropy data
XVI	Bibliographic data
XVII	Ion data
XVIII	Bad calculations
XIX	Index of properties
XX	H-bond dimers
XXI	Oddities

---

NIST policy on privacy, security, and accessibility.

---

© 2013 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved.

The National Institute of Standards and Technology (NIST) is an agency of the U.S. Department of Commerce.

Please send questions, comments, corrections, additions and suggestions to cccbdb@nist.gov.

I.B.1.d.2.

Bonds types in CCCBDB

All species with F-S bond.

Species	Name	List all bonds	Experimental data
SF	Monosulfur monofluoride	List all bonds	Experimental data
SF-	sulfur monofluoride anion	List all bonds	Experimental data
SF+	sulfur monofluoride cation	List all bonds	Experimental data
FSN	Thiazyl fluoride	List all bonds	Experimental data
SF2	sulfur difluoride	List all bonds	Experimental data
SF2-	sulfur difluoride anion	List all bonds	Experimental data
SF2+	sulfur difluoride cation	List all bonds	Experimental data
SFCl	Sulfur chloride fluoride	List all bonds	Experimental data
F2SO	Thionyl Fluoride	List all bonds	Experimental data
FSSF	Difluorodisulfane	List all bonds	Experimental data
S2F2	Thio-thionyl fluoride	List all bonds	Experimental data
SF3	Sulfur trifluoride	List all bonds	Experimental data
SO2F2	Sulfuryl fluoride	List all bonds	Experimental data
SF4	Sulfur tetrafluoride	List all bonds	Experimental data
SOF4	Sulfur tetrafluoride oxide	List all bonds	Experimental data
SF5	Sulfur pentafluoride	List all bonds	Experimental data
SF5+	pentafluoro sulfur cation	List all bonds	Experimental data
SF6	Sulfur Hexafluoride	List all bonds	Experimental data
SF5Cl	sulfur chloropentafluoride	List all bonds	Experimental data
SF5CF3	Sulfur, pentafluoro(trifluoromethyl)-	List all bonds	Experimental data
S2F10	disulphur decafluoride	List all bonds	Experimental data