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Geometry for COHCl (Formyl chloride) 1A' CS

1910171554
InChI=1S/CHClO/c2-1-3/h1H INChIKey=GFAUNYMRSKVDJL-UHFFFAOYSA-N

B3LYP/LANL2DZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.8434 0.0000   0.7111 0.4534 0.0000
O2 1.1510 1.2194 0.0000   0.4093 1.6261 0.0000
Cl3 -0.4882 -0.9569 0.0000   -0.5444 -0.9261 0.0000
H4 -0.9093 1.4527 0.0000   1.7138 0.0143 0.0000
Atom - Atom Distances (Å)
  C1 O2 Cl3 H4
C1 1.2109 1.8653 1.0946
O2 1.2109 2.7246 2.0735
Cl3 1.8653 2.7246 2.4462
H4 1.0946 2.0735 2.4462
Maximum atom distance is 2.7246Å between atoms O2 and Cl3.
picture of Formyl chloride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 C1 Cl3 123.262
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 C1 H4 128.081 Cl3 C1 H4 108.657

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