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Geometry for C5H6 (3-Penten-1-yne, (Z)-) 1A' CS

1910171554
InChI=1S/C5H6/c1-3-5-4-2/h1,4-5H,2H3/b5-4- INChIKey=XAJOPMVSQIBJCW-PLNGDYQASA-N

B97D3/6-311G*


Point group is not available
Atom Internal
x (Å) y (Å) z (Å)
Atom - Atom Distances (Å)
 
Maximum atom distance is 0.0000Å between atoms and .
picture of 3-Penten-1-yne, (Z)-

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