Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Compare Calculated Bonds for Cl-S

QCISD/3-21G

Histogram of Bond lengths (in Å) vs number of species

Values greater than 2.44 are in the 2.44 bin. Values less than 2.20 are in the 2.20 bin.

	5
	4
	3
	2
	1
	0
		2.20			2.22			2.24			2.26			2.28			2.30			2.32			2.34			2.36			2.38			2.40			2.42			2.44
bond lengths (Å)