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	hartrees
Energy at 0K	-1790.966979
Energy at 298.15K	-1790.970617
HF Energy	-1790.966979
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	764	764	0.00
2	A₁	556	556	0.00
3	A₁	262	262	0.00
4	A₂	644	644	0.00
5	A₂	209	209	0.00
6	B₁	730	730	0.00
7	B₁	336	336	0.00
8	B₂	973	973	1.68
9	B₂	480	480	47.03
10	B₂	244	244	0.25
11	E	821	821	11.82
11	E	821	821	11.82
12	E	693	693	13.22
12	E	693	693	13.22
13	E	482	482	1.82
13	E	482	482	1.82
14	E	168	168	28.41
14	E	168	168	28.41

Atom	x (Å)	y (Å)	z (Å)
N1	1.371	1.371	0.000
N2	-1.371	1.371	0.000
N3	-1.371	-1.371	0.000
N4	1.371	-1.371	0.000
S5	0.000	1.334	1.084
S6	0.000	-1.334	1.084
S7	1.334	0.000	-1.084
S8	-1.334	0.000	-1.084

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.7412	3.8766	2.7412	1.7478	3.2200	1.7478	3.2200
N2	2.7412		2.7412	3.8766	1.7478	3.2200	3.2200	1.7478
N3	3.8766	2.7412		2.7412	3.2200	1.7478	3.2200	1.7478
N4	2.7412	3.8766	2.7412		3.2200	1.7478	1.7478	3.2200
S5	1.7478	1.7478	3.2200	3.2200		2.6681	2.8738	2.8738
S6	3.2200	3.2200	1.7478	1.7478	2.6681		2.8738	2.8738
S7	1.7478	3.2200	3.2200	1.7478	2.8738	2.8738		2.6681
S8	3.2200	1.7478	1.7478	3.2200	2.8738	2.8738	2.6681

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	103.294	N1	S7	N4	103.294
N2	S8	N3	103.294	N3	S6	N4	103.294
S5	N1	S7	110.599	S5	N2	S8	110.599
S6	N3	S8	110.599	S6	N4	S7	110.599

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

using model chemistry: wB97X-D/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	N	-0.387
2	N	-0.387
3	N	-0.387
4	N	-0.387
5	S	0.387
6	S	0.387
7	S	0.387
8	S	0.387

<r²>	336.714
(<r²>)^1/2	18.350

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

using model chemistry: wB97X-D/STO-3G

States and conformations

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