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Geometry for HCNO (fulminic acid) 1A' CS

1910171554
InChI=1S/CHNO/c1-2-3/h1H INChIKey=UXKUODQYLDZXDL-UHFFFAOYSA-N

BLYP/STO-3G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 -1.1492 -0.4929 0.0000   -1.2496 -0.0461 0.0000
N2 0.0000 0.1006 0.0000   0.0362 0.0939 0.0000
C3 1.2335 0.3263 0.0000   1.2683 -0.1397 0.0000
H4 1.7925 1.2813 0.0000   2.1336 0.5501 0.0000
Atom - Atom Distances (Å)
  O1 N2 C3 H4
O1 1.2934 2.5196 3.4353
N2 1.2934 1.2540 2.1464
C3 2.5196 1.2540 1.1065
H4 3.4353 2.1464 1.1065
Maximum atom distance is 3.4353Å between atoms O1 and H4.
picture of fulminic acid
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O1 N2 C3 163.054
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N2 C3 H4 130.708

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