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Geometry for C2H (Ethynyl radical) 2Σ C*V

1910171554
InChI=1S/C2H/c1-2/h1H INChIKey=XEHVFKKSDRMODV-UHFFFAOYSA-N

B3PW91/cc-pVTZ


Point group is C∞v
Atom Internal
x (Å) y (Å) z (Å)
C1 0.0000 0.0000 -0.4721
C2 0.0000 0.0000 0.7283
H3 0.0000 0.0000 -1.5368
Atom - Atom Distances (Å)
  C1 C2 H3
C1 1.2004 1.0646
C2 1.2004 2.2650
H3 1.0646 2.2650
Maximum atom distance is 2.2650Å between atoms C2 and H3.
picture of Ethynyl radical
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
C2 C1 H3 180.000

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