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	hartrees
Energy at 0K	-640.836644
Energy at 298.15K	-640.843779
HF Energy	-640.836644
Nuclear repulsion energy	263.559294

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3430	3288	44.30
2	A'	3214	3081	2.59
3	A'	3102	2974	0.86
4	A'	1615	1549	42.46
5	A'	1493	1431	15.21
6	A'	1419	1360	9.28
7	A'	1061	1018	49.32
8	A'	968	928	43.58
9	A'	900	863	134.68
10	A'	668	641	13.24
11	A'	588	564	226.14
12	A'	427	409	11.97
13	A'	370	355	68.81
14	A'	262	251	3.48
15	A"	3569	3422	52.19
16	A"	3215	3083	2.86
17	A"	1510	1447	13.61
18	A"	1231	1180	64.68
19	A"	1052	1008	5.02
20	A"	1006	965	0.75
21	A"	330	316	2.37
22	A"	261	250	14.28
23	A"	179	171	42.43
24	A"	106	101	0.01

Atom	x (Å)	y (Å)	z (Å)
C1	-0.540	1.644	0.000
S2	-0.109	-0.135	0.000
N3	1.631	-0.000	0.000
O4	-0.540	-0.799	1.363
O5	-0.540	-0.799	-1.363
H6	-1.625	1.728	0.000
H7	-0.105	2.075	0.900
H8	-0.105	2.075	-0.900
H9	2.018	-0.403	0.861
H10	2.018	-0.403	-0.861

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.8304	2.7233	2.7976	2.7976	1.0887	1.0882	1.0882	3.3874	3.3874
S2	1.8304		1.7449	1.5762	1.5762	2.4019	2.3860	2.3860	2.3101	2.3101
N3	2.7233	1.7449		2.6848	2.6848	3.6864	2.8511	2.8511	1.0260	1.0260
O4	2.7976	1.5762	2.6848		2.7257	3.0693	2.9437	3.6836	2.6370	3.4125
O5	2.7976	1.5762	2.6848	2.7257		3.0693	3.6836	2.9437	3.4125	2.6370
H6	1.0887	2.4019	3.6864	3.0693	3.0693		1.8006	1.8006	4.3077	4.3077
H7	1.0882	2.3860	2.8511	2.9437	3.6836	1.8006		1.7990	3.2632	3.7074
H8	1.0882	2.3860	2.8511	3.6836	2.9437	1.8006	1.7990		3.7074	3.2632
H9	3.3874	2.3101	1.0260	2.6370	3.4125	4.3077	3.2632	3.7074		1.7211
H10	3.3874	2.3101	1.0260	3.4125	2.6370	4.3077	3.7074	3.2632	1.7211

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	99.199	C1	S2	O4	110.192
C1	S2	O5	110.192	S2	C1	H6	108.031
S2	C1	H7	106.902	S2	C1	H8	106.902
S2	N3	H9	110.251	S2	N3	H10	110.251
N3	S2	O4	107.772	N3	S2	O5	107.772
O4	S2	O5	119.678	H6	C1	H7	111.609
H6	C1	H8	111.609	H7	C1	H8	111.496
H9	N3	H10	114.020

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: M06-2X/3-21G

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	C	-0.912
2	S	1.497
3	N	-0.891
4	O	-0.605
5	O	-0.605
6	H	0.277
7	H	0.275
8	H	0.275
9	H	0.345
10	H	0.345

	x	y	z	Total
	2.632	3.104	0.000	4.070
CHELPG
AIM
ESP

	x	y	z
x	5.681	-0.241	0.000
y	-0.241	5.453	0.000
z	0.000	0.000	5.870

<r²>	131.026
(<r²>)^1/2	11.447

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: M06-2X/3-21G

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)