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	hartrees
Energy at 0K	-644.610319
Energy at 298.15K	-644.618007
HF Energy	-644.610319
Nuclear repulsion energy	277.117619

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3488	3377	28.51
2	A'	3160	3060	0.80
3	A'	3060	2963	0.48
4	A'	1589	1538	29.63
5	A'	1466	1419	4.68
6	A'	1348	1305	10.23
7	A'	1143	1106	162.71
8	A'	981	950	24.04
9	A'	874	846	97.02
10	A'	707	684	24.71
11	A'	665	644	209.23
12	A'	485	469	39.47
13	A'	462	448	10.04
14	A'	283	274	4.19
15	A"	3593	3479	38.01
16	A"	3169	3068	1.30
17	A"	1467	1421	0.94
18	A"	1359	1316	226.99
19	A"	1087	1052	3.84
20	A"	967	936	0.77
21	A"	384	372	0.17
22	A"	319	309	3.02
23	A"	214	207	2.91
24	A"	178	173	31.39

Atom	x (Å)	y (Å)	z (Å)
C1	-1.680	-0.056	0.000
S2	0.109	-0.135	0.000
N3	0.532	1.497	0.000
O4	0.532	-0.702	1.271
O5	0.532	-0.702	-1.271
H6	-2.031	-1.087	0.000
H7	-2.002	0.465	0.899
H8	-2.002	0.465	-0.899
H9	1.072	1.698	0.836
H10	1.072	1.698	-0.836

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.7900	2.7024	2.6309	2.6309	1.0889	1.0877	1.0877	3.3678	3.3678
S2	1.7900		1.6863	1.4545	1.4545	2.3423	2.3716	2.3716	2.2323	2.2323
N3	2.7024	1.6863		2.5400	2.5400	3.6396	2.8804	2.8804	1.0150	1.0150
O4	2.6309	1.4545	2.5400		2.5421	2.8868	2.8144	3.5341	2.4974	3.2383
O5	2.6309	1.4545	2.5400	2.5421		2.8868	3.5341	2.8144	3.2383	2.4974
H6	1.0889	2.3423	3.6396	2.8868	2.8868		1.7929	1.7929	4.2519	4.2519
H7	1.0877	2.3716	2.8804	2.8144	3.5341	1.7929		1.7974	3.3126	3.7388
H8	1.0877	2.3716	2.8804	3.5341	2.8144	1.7929	1.7974		3.7388	3.3126
H9	3.3678	2.2323	1.0150	2.4974	3.2383	4.2519	3.3126	3.7388		1.6718
H10	3.3678	2.2323	1.0150	3.2383	2.4974	4.2519	3.7388	3.3126	1.6718

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	102.000	C1	S2	O4	107.917
C1	S2	O5	107.917	S2	C1	H6	106.332
S2	C1	H7	108.525	S2	C1	H8	108.525
S2	N3	H9	108.917	S2	N3	H10	108.917
N3	S2	O4	107.715	N3	S2	O5	107.715
O4	S2	O5	121.820	H6	C1	H7	110.917
H6	C1	H8	110.917	H7	C1	H8	111.433
H9	N3	H10	110.887

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: TPSSh/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	C	-0.208
2	S	0.807
3	N	-0.324
4	O	-0.446
5	O	-0.446
6	H	0.102
7	H	0.098
8	H	0.098
9	H	0.159
10	H	0.159

	x	y	z	Total
	-1.590	2.892	0.000	3.300
CHELPG
AIM
ESP

	x	y	z
x	6.936	0.349	0.000
y	0.349	6.592	0.000
z	0.000	0.000	6.605

<r²>	120.843
(<r²>)^1/2	10.993

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: TPSSh/cc-pVTZ

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)