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	hartrees
Energy at 0K	-1805.940539
Energy at 298.15K	-1805.943459
HF Energy	-1805.940539
Nuclear repulsion energy	728.282822

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	588	576	0.00
2	A₁	501	491	0.00
3	A₁	159	155	0.00
4	A₂	471	461	0.00
5	A₂	124	121	0.00
6	B₁	547	536	0.00
7	B₁	277	271	0.00
8	B₂	787	771	9.55
9	B₂	458	449	64.37
10	B₂	146	143	0.38
11	E	652	639	4.74
11	E	652	639	4.74
12	E	523	512	26.27
12	E	523	512	26.27
13	E	411	403	12.83
13	E	411	403	12.83
14	E	189	186	15.65
14	E	189	186	15.65

Atom	x (Å)	y (Å)	z (Å)
N1	1.421	1.421	0.000
N2	-1.421	1.421	0.000
N3	-1.421	-1.421	0.000
N4	1.421	-1.421	0.000
S5	0.000	1.500	1.050
S6	0.000	-1.500	1.050
S7	1.500	0.000	-1.050
S8	-1.500	0.000	-1.050

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.8415	4.0185	2.8415	1.7682	3.4137	1.7682	3.4137
N2	2.8415		2.8415	4.0185	1.7682	3.4137	3.4137	1.7682
N3	4.0185	2.8415		2.8415	3.4137	1.7682	3.4137	1.7682
N4	2.8415	4.0185	2.8415		3.4137	1.7682	1.7682	3.4137
S5	1.7682	1.7682	3.4137	3.4137		3.0008	2.9848	2.9848
S6	3.4137	3.4137	1.7682	1.7682	3.0008		2.9848	2.9848
S7	1.7682	3.4137	3.4137	1.7682	2.9848	2.9848		3.0008
S8	3.4137	1.7682	1.7682	3.4137	2.9848	2.9848	3.0008

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	106.932	N1	S7	N4	106.932
N2	S8	N3	106.932	N3	S6	N4	106.932
S5	N1	S7	115.135	S5	N2	S8	115.135
S6	N3	S8	115.135	S6	N4	S7	115.135

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

using model chemistry: LSDA/6-31G

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	-0.647
2	N	-0.647
3	N	-0.647
4	N	-0.647
5	S	0.647
6	S	0.647
7	S	0.647
8	S	0.647

<r²>	375.878
(<r²>)^1/2	19.388

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

using model chemistry: LSDA/6-31G

States and conformations

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