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	hartrees
Energy at 0K	-454.603429
Energy at 298.15K	-454.607429
HF Energy	-454.603429
Nuclear repulsion energy	52.959604

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3480	3480	18.63
2	A₁	1376	1376	116.06
3	A₁	599	599	14.87
4	E	3615	3615	83.07
4	E	3615	3615	83.13
5	E	1725	1725	62.75
5	E	1725	1725	62.49
6	E	852	852	55.23
6	E	852	852	55.67

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.150
S2	0.000	0.000	0.779
H3	0.000	0.965	-1.472
H4	0.836	-0.483	-1.472
H5	-0.836	-0.483	-1.472

	N1	S2	H3	H4	H5
N1		1.9294	1.0176	1.0176	1.0176
S2	1.9294		2.4491	2.4491	2.4491
H3	1.0176	2.4491		1.6723	1.6723
H4	1.0176	2.4491	1.6723		1.6723
H5	1.0176	2.4491	1.6723	1.6723

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S2	N1	H3	108.409	S2	N1	H4	108.409
S2	N1	H5	108.409	H3	N1	H4	110.512
H3	N1	H5	110.512	H4	N1	H5	110.512

All results from a given calculation for NH₃S (sulfidoazane)

using model chemistry: M06-2X/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	-0.890
2	S	-0.312
3	H	0.401
4	H	0.401
5	H	0.401

	x	y	z	Total
	0.000	0.000	-6.478	6.478
CHELPG
AIM
ESP

	x	y	z
x	2.017	0.000	0.000
y	0.000	2.023	0.002
z	0.000	0.002	3.979

<r²>	40.030
(<r²>)^1/2	6.327

All results from a given calculation for NH3S (sulfidoazane)

using model chemistry: M06-2X/6-31G

States and conformations

All results from a given calculation for NH₃S (sulfidoazane)