III.G.1.a.

Compare Calculated Bonds for N-O

QCISD(T)/aug-cc-pVTZ

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

Values greater than 1.36 are in the 1.36 bin. Values less than 1.12 are in the 1.12 bin.

	5
	4
	3
	2
	1
	0
		1.12			1.14			1.16			1.18			1.20			1.22			1.24			1.26			1.28			1.30			1.32			1.34			1.36
bond lengths (Å)

Summary: (Å)

Average bond length	Standard deviation
1.232	0.079

	Species	Name	Bond Length (Å)
Lowest value	HNO-	Nitrosyl hydride anion	1.132
Highest value	HNO-	Nitrosyl hydride anion	1.341

Calculated Bond lengths
Click on entry for all calculated results.

Species	Name	Bond Length (Å)	Atom1 index	Atom2 index
HNO2	Nitrous acid	1.311	2	3
HNO2+	nitrous acid cation	1.311	2	3
HNO2	Nitrous acid	1.143	3	4
HNO2+	nitrous acid cation	1.143	3	4
N2O-	Nitrous oxide anion	1.200	2	3
N2O	Nitrous oxide	1.200	2	3
N2O+	Nitrous oxide cation	1.200	2	3
NO-	nitric oxide anion	1.259	1	2
NO	Nitric oxide	1.259	1	2
NO+	nitric oxide cation	1.259	1	2
HNO-	Nitrosyl hydride anion	1.132	2	3
HNO	Nitrosyl hydride	1.132	2	3
HNO+	Nitrosyl hydride cation	1.132	2	3
HNO-	Nitrosyl hydride anion	1.341	2	3
HNO	Nitrosyl hydride	1.341	2	3
HNO+	Nitrosyl hydride cation	1.341	2	3