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	hartrees
Energy at 0K	-1811.671688
Energy at 298.15K	-1811.675338
HF Energy	-1811.671688
Nuclear repulsion energy	757.686440

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	618	615	0.00
2	A₁	545	543	0.00
3	A₁	148	148	0.00
4	A₂	587	585	0.00
5	A₂	182	182	0.00
6	B₁	615	612	0.00
7	B₁	303	302	0.00
8	B₂	864	860	44.62
9	B₂	514	512	71.42
10	B₂	119	119	0.00
11	E	648	646	12.18
11	E	648	646	12.18
12	E	588	586	74.69
12	E	588	586	74.69
13	E	467	465	11.96
13	E	467	465	11.96
14	E	262	260	24.47
14	E	262	260	24.47

Atom	x (Å)	y (Å)	z (Å)
N1	1.359	1.359	0.000
N2	-1.359	1.359	0.000
N3	-1.359	-1.359	0.000
N4	1.359	-1.359	0.000
S5	0.000	1.506	0.959
S6	0.000	-1.506	0.959
S7	1.506	0.000	-0.959
S8	-1.506	0.000	-0.959

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.7181	3.8440	2.7181	1.6699	3.3130	1.6699	3.3130
N2	2.7181		2.7181	3.8440	1.6699	3.3130	3.3130	1.6699
N3	3.8440	2.7181		2.7181	3.3130	1.6699	3.3130	1.6699
N4	2.7181	3.8440	2.7181		3.3130	1.6699	1.6699	3.3130
S5	1.6699	1.6699	3.3130	3.3130		3.0122	2.8665	2.8665
S6	3.3130	3.3130	1.6699	1.6699	3.0122		2.8665	2.8665
S7	1.6699	3.3130	3.3130	1.6699	2.8665	2.8665		3.0122
S8	3.3130	1.6699	1.6699	3.3130	2.8665	2.8665	3.0122

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	108.947	N1	S7	N4	108.947
N2	S8	N3	108.947	N3	S6	N4	108.947
S5	N1	S7	118.245	S5	N2	S8	118.245
S6	N3	S8	118.245	S6	N4	S7	118.245

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

using model chemistry: BLYP/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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Number	Element	Mulliken
1	N	-0.543
2	N	-0.543
3	N	-0.543
4	N	-0.543
5	S	0.543
6	S	0.543
7	S	0.543
8	S	0.543

<r²>	354.510
(<r²>)^1/2	18.828

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

using model chemistry: BLYP/6-311G**

States and conformations

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