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	hartrees
Energy at 0K	-454.728503
Energy at 298.15K	-454.732538
HF Energy	-454.728503
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3480	3329	3.68
2	A₁	1349	1290	46.61
3	A₁	644	616	3.15
4	E	3579	3424	74.47
4	E	3579	3424	74.57
5	E	1659	1587	32.86
5	E	1659	1587	32.94
6	E	863	826	12.78
6	E	863	826	12.79

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.083
S2	0.000	0.000	0.743
H3	0.000	0.951	-1.435
H4	0.824	-0.476	-1.435
H5	-0.824	-0.476	-1.435

	N1	S2	H3	H4	H5
N1		1.8255	1.0142	1.0142	1.0142
S2	1.8255		2.3762	2.3762	2.3762
H3	1.0142	2.3762		1.6474	1.6474
H4	1.0142	2.3762	1.6474		1.6474
H5	1.0142	2.3762	1.6474	1.6474

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S2	N1	H3	110.308	S2	N1	H4	110.308
S2	N1	H5	110.308	H3	N1	H4	108.622
H3	N1	H5	108.622	H4	N1	H5	108.622

All results from a given calculation for NH₃S (sulfidoazane)

using model chemistry: wB97X-D/aug-cc-pVTZ

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	0.216
2	S	-0.517
3	H	0.101
4	H	0.101
5	H	0.101

	x	y	z	Total
	0.000	0.000	-6.010	6.010
CHELPG
AIM
ESP

	x	y	z
x	5.437	0.000	0.000
y	0.000	5.443	-0.001
z	0.000	-0.001	6.134

<r²>	37.949
(<r²>)^1/2	6.160

All results from a given calculation for NH3S (sulfidoazane)

using model chemistry: wB97X-D/aug-cc-pVTZ

States and conformations

All results from a given calculation for NH₃S (sulfidoazane)