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	hartrees
Energy at 0K	-1808.956456
Energy at 298.15K	-1808.961074
HF Energy	-1807.638922
Nuclear repulsion energy	792.077711

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	726	695	0.00
2	A₁	590	564	0.00
3	A₁	207	199	0.00
4	A₂	760	728	0.00
5	A₂	260	249	0.00
6	B₁	731	700	0.00
7	B₁	348	334	0.00
8	B₂	998	955	83.63
9	B₂	584	559	97.06
10	B₂	172	165	0.57
11	E	734	703	0.03
11	E	734	703	0.03
12	E	701	671	132.37
12	E	701	671	132.37
13	E	522	500	7.26
13	E	522	500	7.26
14	E	290	277	50.95
14	E	290	277	50.98

Atom	x (Å)	y (Å)	z (Å)
N1	1.301	1.301	0.000
N2	-1.301	1.301	0.000
N3	-1.301	-1.301	0.000
N4	1.301	-1.301	0.000
S5	0.000	1.365	0.983
S6	0.000	-1.365	0.983
S7	1.365	0.000	-0.983
S8	-1.365	0.000	-0.983

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.6012	3.6786	2.6012	1.6318	3.1251	1.6318	3.1251
N2	2.6012		2.6012	3.6786	1.6318	3.1251	3.1251	1.6318
N3	3.6786	2.6012		2.6012	3.1251	1.6318	3.1251	1.6318
N4	2.6012	3.6786	2.6012		3.1251	1.6318	1.6318	3.1251
S5	1.6318	1.6318	3.1251	3.1251		2.7309	2.7562	2.7562
S6	3.1251	3.1251	1.6318	1.6318	2.7309		2.7562	2.7562
S7	1.6318	3.1251	3.1251	1.6318	2.7562	2.7562		2.7309
S8	3.1251	1.6318	1.6318	3.1251	2.7562	2.7562	2.7309

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	105.698	N1	S7	N4	105.698
N2	S8	N3	105.698	N3	S6	N4	105.698
S5	N1	S7	115.246	S5	N2	S8	115.246
S6	N3	S8	115.246	S6	N4	S7	115.246

All results from a given calculation for S₄N₄ (Tetrasulfur tetranitride)

using model chemistry: QCISD/6-311G*

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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All results from a given calculation for S4N4 (Tetrasulfur tetranitride)

using model chemistry: QCISD/6-311G*

States and conformations

All results from a given calculation for S₄N₄ (Tetrasulfur tetranitride)