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	hartrees
Energy at 0K	-1807.625872
Energy at 298.15K	-1807.631701
HF Energy	-1807.625872
Nuclear repulsion energy	830.784923

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	852	772	0.00
2	A₁	653	591	0.00
3	A₁	288	261	0.00
4	A₂	885	801	0.00
5	A₂	346	314	0.00
6	B₁	865	783	0.00
7	B₁	420	381	0.00
8	B₂	1090	987	163.45
9	B₂	646	585	92.86
10	B₂	239	216	2.10
11	E	874	791	81.46
11	E	874	791	81.46
12	E	819	742	87.61
12	E	819	742	87.61
13	E	637	577	1.24
13	E	637	577	1.24
14	E	420	380	45.12
14	E	420	380	45.12

Atom	x (Å)	y (Å)	z (Å)
N1	1.259	1.259	0.000
N2	-1.259	1.259	0.000
N3	-1.259	-1.259	0.000
N4	1.259	-1.259	0.000
S5	0.000	1.224	0.982
S6	0.000	-1.224	0.982
S7	1.224	0.000	-0.982
S8	-1.224	0.000	-0.982

	N1	N2	N3	N4	S5	S6	S7	S8
N1		2.5185	3.5616	2.5185	1.5974	2.9524	1.5974	2.9524
N2	2.5185		2.5185	3.5616	1.5974	2.9524	2.9524	1.5974
N3	3.5616	2.5185		2.5185	2.9524	1.5974	2.9524	1.5974
N4	2.5185	3.5616	2.5185		2.9524	1.5974	1.5974	2.9524
S5	1.5974	1.5974	2.9524	2.9524		2.4480	2.6184	2.6184
S6	2.9524	2.9524	1.5974	1.5974	2.4480		2.6184	2.6184
S7	1.5974	2.9524	2.9524	1.5974	2.6184	2.6184		2.4480
S8	2.9524	1.5974	1.5974	2.9524	2.6184	2.6184	2.4480

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	S5	N2	104.052	N1	S7	N4	104.052
N2	S8	N3	104.052	N3	S6	N4	104.052
S5	N1	S7	110.081	S5	N2	S8	110.081
S6	N3	S8	110.081	S6	N4	S7	110.081

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

using model chemistry: HF/6-31G(2df,p)

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	-0.456
2	N	-0.456
3	N	-0.456
4	N	-0.456
5	S	0.456
6	S	0.456
7	S	0.456
8	S	0.456

<r²>	292.661
(<r²>)^1/2	17.107

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

using model chemistry: HF/6-31G(2df,p)

States and conformations

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