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Computational Chemistry Comparison and Benchmark DataBase
Release 22 (May 2022) Standard Reference Database 101
National Institute of Standards and Technology
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Geometry for NOH+ (O-protonated nitric oxide)
2A' CS
1910171554
InChI=1S/HNO/c1-2/h2H/q+1 INChIKey=MWUXSHHQAYIFBG-UHFFFAOYSA-O
B3LYP_cp/6-31G*
Point group is Cs
| Atom |
Internal |
| x (Å) |
y (Å) |
z (Å) |
| N1 |
0.0569 |
0.6957 |
0.0000 |
| O2 |
0.0569 |
-0.4873 |
0.0000 |
| H3 |
-0.8541 |
-0.9713 |
0.0000 |
Atom - Atom Distances (Å)
| |
N1 |
O2 |
H3 |
| N1 |
|
1.1830 |
1.8996 |
| O2 |
1.1830 |
|
1.0316 |
| H3 |
1.8996 |
1.0316 |
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Maximum atom distance is 1.8996Å
between atoms N1 and H3.
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
| atom1 |
atom2 |
atom3 |
angle |
|
atom1 |
atom2 |
atom3 |
angle |
Calculated Bond Angles (degrees) (Involving Hydrogens)
| atom1 |
atom2 |
atom3 |
angle |
|
atom1 |
atom2 |
atom3 |
angle |
For information on specific bond angles or dihedrals
see the geometry comparison page in section
Comparisons > Geometry > Bonds, angles.