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II.A.3. (XII.A.1.)

Listing of experimental geometry data for LiOH (lithium hydroxide)

Rotational Constants (cm-1)
See section I.F.4 to change rotational constant units
A B C
  1.17891  
Rotational Constants from 1994McN/Tac:313
Calculated rotational constants for LiOH (lithium hydroxide).

Point Group C∞v

Internal coordinates (distances (r) in Å) (angles (a) in degrees) (dihedrals (d) in degrees)
Description Value Connectivity Reference Comment
Atom 1 Atom 2 Atom 3 Atom 4
rLiO 1.582 1 2 1994McN/Tac:313 r0=1.5936
rOH 0.969 1 3 1994McN/Tac:313 r0=0.9217
aHOLi 180 2 1 3 1994McN/Tac:313
picture of lithium hydroxide

Bond descriptions
Examples: C-C single bond, C=C, double bond, C#C triple bond, C:C aromatic bond
Bond Type Count
H-O 1
Li-O 1

Atom x (Å) y (Å) z (Å)
O1 0.0000 0.0000 0.0000
Li2 0.0000 0.0000 -1.5816
H3 0.0000 0.0000 0.9691

Atom - Atom Distances (Å)
  O1 Li2 H3
O11.58160.9691
Li21.58162.5507
H30.96912.5507

Calculated geometries for LiOH (lithium hydroxide).


References
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squib reference DOI
1994McN/Tac:313 McNaughton, D.; Tack, L.M.; Kleibomer, B.; Godfrey, P.D. "Rotational Spectrum and Bending Potential of LiOH: A Semirigid Bender Analysis." Structural Chemistry. 5, 313-319 (1994) 10.1007/BF02281222

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