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	hartrees
Energy at 0K	-1790.151602
Energy at 298.15K	-1790.155158
HF Energy	-1789.894946
Nuclear repulsion energy	731.490216

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	707	707	0.00
2	A₁	508	508	0.00
3	A₁	186	186	0.00
4	A₂	541	541	0.00
5	A₂	138	138	0.00
6	B₁	679	679	0.00
7	B₁	278	278	0.00
8	B₂	934	934	0.16
9	B₂	462	462	46.18
10	B₂	196	196	0.19
11	E	937	937	0.73
11	E	937	937	0.73
12	E	729	729	1.66
12	E	729	729	1.66
13	E	433	433	12.86
13	E	433	433	12.86
14	E	325	325	0.01
14	E	325	325	0.01

Atom	x (Å)	y (Å)	z (Å)
N1	1.413	1.413	0.000
N2	-1.413	1.413	0.000
N3	-1.413	-1.413	0.000
N4	1.413	-1.413	0.000
S5	0.000	1.475	1.063
S6	0.000	-1.475	1.063
S7	1.475	0.000	-1.063
S8	-1.475	0.000	-1.063

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.8254	3.9957	2.8254	1.7692	3.3859	1.7692	3.3859
N2	2.8254		2.8254	3.9957	1.7692	3.3859	3.3859	1.7692
N3	3.9957	2.8254		2.8254	3.3859	1.7692	3.3859	1.7692
N4	2.8254	3.9957	2.8254		3.3859	1.7692	1.7692	3.3859
S5	1.7692	1.7692	3.3859	3.3859		2.9497	2.9787	2.9787
S6	3.3859	3.3859	1.7692	1.7692	2.9497		2.9787	2.9787
S7	1.7692	3.3859	3.3859	1.7692	2.9787	2.9787		2.9497
S8	3.3859	1.7692	1.7692	3.3859	2.9787	2.9787	2.9497

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	105.970	N1	S7	N4	105.970
N2	S8	N3	105.970	N3	S6	N4	105.970
S5	N1	S7	114.665	S5	N2	S8	114.665
S6	N3	S8	114.665	S6	N4	S7	114.665

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

using model chemistry: B2PLYP/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	-0.339
2	N	-0.339
3	N	-0.339
4	N	-0.339
5	S	0.339
6	S	0.339
7	S	0.339
8	S	0.339

<r²>	365.335
(<r²>)^1/2	19.114

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

using model chemistry: B2PLYP/STO-3G

States and conformations

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