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	hartrees
Energy at 0K	-454.625524
Energy at 298.15K	-454.629534
HF Energy	-454.625524
Nuclear repulsion energy	54.504619

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3434	3285	1.92
2	A₁	1387	1327	18.10
3	A₁	610	583	4.00
4	E	3540	3387	61.82
4	E	3540	3387	61.82
5	E	1696	1622	38.94
5	E	1696	1622	38.93
6	E	868	830	48.43
6	E	868	830	48.43

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.094
S2	0.000	0.000	0.752
H3	0.000	0.954	-1.459
H4	0.826	-0.477	-1.459
H5	-0.826	-0.477	-1.459

	N1	S2	H3	H4	H5
N1		1.8457	1.0212	1.0212	1.0212
S2	1.8457		2.4076	2.4076	2.4076
H3	1.0212	2.4076		1.6520	1.6520
H4	1.0212	2.4076	1.6520		1.6520
H5	1.0212	2.4076	1.6520	1.6520

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S2	N1	H3	110.938	S2	N1	H4	110.938
S2	N1	H5	110.938	H3	N1	H4	107.966
H3	N1	H5	107.966	H4	N1	H5	107.966

All results from a given calculation for NH₃S (sulfidoazane)

using model chemistry: B3PW91/6-31G*

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	-0.840
2	S	-0.392
3	H	0.411
4	H	0.411
5	H	0.411

	x	y	z	Total
	0.000	0.000	-6.487	6.487
CHELPG
AIM
ESP

<r²>	38.184
(<r²>)^1/2	6.179

All results from a given calculation for NH3S (sulfidoazane)

using model chemistry: B3PW91/6-31G*

States and conformations

All results from a given calculation for NH₃S (sulfidoazane)