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	hartrees
Energy at 0K	-62.206505
Energy at 298.15K
HF Energy	-62.206505
Nuclear repulsion energy	15.661524

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3927	3207	12.59	178.29	0.05	0.10
2	A₁	1992	1627	2.78	23.40	0.75	0.85
3	A₁	1073	876	86.45	21.13	0.22	0.36
4	B₁	740	604	65.92	8.71	0.75	0.86
5	B₂	4074	3327	8.17	89.23	0.75	0.86
6	B₂	438	358	203.82	0.06	0.75	0.86

Atom	y (Å)	z (Å)
Li1	0.000	-1.333
N2	0.000	0.301
H3	0.800	0.945
H4	-0.800	0.945

	Li1	N2	H3	H4
Li1		1.6348	2.4145	2.4145
N2	1.6348		1.0264	1.0264
H3	2.4145	1.0264		1.5992
H4	2.4145	1.0264	1.5992

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Li1	N2	H3	128.826		Li1	N2	H4	128.826
H3	N2	H4	102.347

All results from a given calculation for LiNH₂ (lithium amide)

using model chemistry: HF/STO-3G

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	Li	0.218
2	N	-0.457
3	H	0.119
4	H	0.119

	x	y	z	Total
	0.000	0.000	-2.238	2.238
CHELPG
AIM
ESP

<r²>	13.546
(<r²>)^1/2	3.681

All results from a given calculation for LiNH2 (lithium amide)

using model chemistry: HF/STO-3G

States and conformations

All results from a given calculation for LiNH₂ (lithium amide)