return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
You are here: Home > Geometry > Calculated > Calculated geometry OR Calculated > Geometry > Calculated geometry

Geometry for FNO (Nitrosyl fluoride) 1A' CS

1910171554
InChI=1S/FNO/c1-2-3 INChIKey=ZEIYBPGWHWECHV-UHFFFAOYSA-N

QCISD/6-31G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
F1 -0.9641 -0.5654 0.0000   1.1153 0.0728 0.0000
N2 0.0000 0.5579 0.0000   -0.2503 -0.4986 0.0000
O3 1.0846 0.1479 0.0000   -1.0357 0.3544 0.0000
Atom - Atom Distances (Å)
  F1 N2 O3
F1 1.4803 2.1694
N2 1.4803 1.1595
O3 2.1694 1.1595
Maximum atom distance is 2.1694Å between atoms F1 and O3.
picture of Nitrosyl fluoride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F1 N2 O3 109.932

For information on specific bond angles or dihedrals see the geometry comparison page in section Comparisons > Geometry > Bonds, angles.