|
Computational Chemistry Comparison and Benchmark DataBase
Release 22 (May 2022) Standard Reference Database 101
National Institute of Standards and Technology
|
|
You are here: Home > Geometry > Calculated > Calculated geometry OR Calculated > Geometry > Calculated geometry
|
Geometry for LiC (Lithium Carbide)
4Σ C*V
1910171554
InChI=1S/C.Li INChIKey=YZSKZXUDGLALTQ-UHFFFAOYSA-N
B1B95/STO-3G
Point group is C∞v
Atom |
Internal |
x (Å) |
y (Å) |
z (Å) |
Li1 |
0.0000 |
0.0000 |
-1.1924 |
C2 |
0.0000 |
0.0000 |
0.5962 |
Atom - Atom Distances (Å)
|
Li1 |
C2 |
Li1 |
| 1.7885 |
C2 |
1.7885 |
|
Maximum atom distance is 1.7885Å
between atoms Li1 and C2.
For information on specific bond angles or dihedrals
see the geometry comparison page in section
Comparisons > Geometry > Bonds, angles.