III.G.1.a.

Compare Calculated Bonds for N-O

CCSD(T)/6-311G**

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

Values greater than 1.24 are in the 1.24 bin. Values less than 1.06 are in the 1.06 bin.

	8
	7
	6
	5
	4
	3
	2
	1
	0
		1.06			1.08			1.10			1.12			1.14			1.16			1.18			1.20			1.22			1.24
bond lengths (Å)

Summary: (Å)

Average bond length	Standard deviation
1.163	0.050

	Species	Name	Bond Length (Å)
Lowest value	NO-	nitric oxide anion	1.072
Highest value	N2O3	Dinitrogen trioxide	1.207

Calculated Bond lengths
Click on entry for all calculated results.

Species	Name	Bond Length (Å)	Atom1 index	Atom2 index
NO-	nitric oxide anion	1.154	1	2
		1.072	1	2
NO	Nitric oxide	1.154	1	2
		1.072	1	2
NO+	nitric oxide cation	1.154	1	2
		1.072	1	2
NO2-	Nitrogen dioxide anion	1.202	1	2
		1.202	1	3
NO2	Nitrogen dioxide	1.202	1	2
		1.202	1	3
NO2+	Nitrogen dioxide cation	1.202	1	2
		1.202	1	3
N2O3	Dinitrogen trioxide	1.149	1	3
		1.207	2	4
		1.206	2	5