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	hartrees
Energy at 0K	-454.503117
Energy at 298.15K	-454.507125
HF Energy	-454.503117
Nuclear repulsion energy	54.683056

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3463	3305	2.55
2	A₁	1356	1294	19.92
3	A₁	617	588	4.66
4	E	3575	3412	67.80
4	E	3575	3412	67.79
5	E	1666	1590	37.64
5	E	1666	1590	37.64
6	E	855	816	45.07
6	E	855	816	45.05

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.090
S2	0.000	0.000	0.749
H3	0.000	0.952	-1.452
H4	0.824	-0.476	-1.452
H5	-0.824	-0.476	-1.452

	N1	S2	H3	H4	H5
N1		1.8395	1.0185	1.0185	1.0185
S2	1.8395		2.3987	2.3987	2.3987
H3	1.0185	2.3987		1.6488	1.6488
H4	1.0185	2.3987	1.6488		1.6488
H5	1.0185	2.3987	1.6488	1.6488

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S2	N1	H3	110.832	S2	N1	H4	110.832
S2	N1	H5	110.832	H3	N1	H4	108.077
H3	N1	H5	108.077	H4	N1	H5	108.077

All results from a given calculation for NH₃S (sulfidoazane)

using model chemistry: HSEh1PBE/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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Number	Element	Mulliken
1	N	-0.658
2	S	-0.395
3	H	0.351
4	H	0.351
5	H	0.351

	x	y	z	Total
	0.000	0.000	-6.471	6.471
CHELPG
AIM
ESP

	x	y	z
x	2.444	0.000	0.000
y	0.000	2.444	-0.000
z	0.000	-0.000	4.231

<r²>	38.034
(<r²>)^1/2	6.167

All results from a given calculation for NH3S (sulfidoazane)

using model chemistry: HSEh1PBE/6-31G**

States and conformations

All results from a given calculation for NH₃S (sulfidoazane)