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III.G.1.a.

Compare Calculated Bonds for N-O

CCSD(T)/aug-cc-pVQZ

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


Values greater than 1.36 are in the 1.36 bin. Values less than 1.14 are in the 1.14 bin.

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histogram chart 2 line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line histogram chart line line line line
histogram chart 1 line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line histogram chart line line line line
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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
1.285 0.084

  Species Name Bond Length (Å)
Lowest value BrNO Nitrosyl bromide 1.140
Highest value HNO- Nitrosyl hydride anion 1.334

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
BrNO Nitrosyl bromide 1.140 1 3
HNO- Nitrosyl hydride anion 1.334 2 3
HNO Nitrosyl hydride 1.334 2 3
HNO+ Nitrosyl hydride cation 1.334 2 3