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	hartrees
Energy at 0K	-644.400068
Energy at 298.15K	-644.407796
HF Energy	-644.400068
Nuclear repulsion energy	277.343532

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3535	3404	41.62
2	A'	3182	3064	0.11
3	A'	3076	2962	0.17
4	A'	1594	1535	46.15
5	A'	1449	1395	8.19
6	A'	1355	1305	18.38
7	A'	1143	1100	194.37
8	A'	991	954	28.14
9	A'	876	844	126.57
10	A'	721	694	10.84
11	A'	655	631	239.05
12	A'	495	477	47.76
13	A'	470	452	9.51
14	A'	294	284	4.83
15	A"	3643	3509	49.63
16	A"	3191	3073	0.30
17	A"	1447	1394	2.27
18	A"	1362	1311	257.58
19	A"	1088	1048	1.80
20	A"	972	936	1.33
21	A"	396	381	0.05
22	A"	328	316	1.99
23	A"	225	217	0.15
24	A"	164	158	40.43

Atom	x (Å)	y (Å)	z (Å)
C1	-1.676	-0.061	0.000
S2	0.109	-0.135	0.000
N3	0.532	1.493	0.000
O4	0.532	-0.698	1.272
O5	0.532	-0.698	-1.272
H6	-2.030	-1.092	0.000
H7	-2.004	0.458	0.899
H8	-2.004	0.458	-0.899
H9	1.057	1.714	0.838
H10	1.057	1.714	-0.838

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.7860	2.6997	2.6262	2.6262	1.0902	1.0888	1.0888	3.3648	3.3648
S2	1.7860		1.6817	1.4542	1.4542	2.3434	2.3718	2.3718	2.2404	2.2404
N3	2.6997	1.6817		2.5336	2.5336	3.6395	2.8832	2.8832	1.0137	1.0137
O4	2.6262	1.4542	2.5336		2.5441	2.8873	2.8122	3.5330	2.5065	3.2477
O5	2.6262	1.4542	2.5336	2.5441		2.8873	3.5330	2.8122	3.2477	2.5065
H6	1.0902	2.3434	3.6395	2.8873	2.8873		1.7919	1.7919	4.2553	4.2553
H7	1.0888	2.3718	2.8832	2.8122	3.5330	1.7919		1.7978	3.3099	3.7376
H8	1.0888	2.3718	2.8832	3.5330	2.8122	1.7919	1.7978		3.7376	3.3099
H9	3.3648	2.2404	1.0137	2.5065	3.2477	4.2553	3.3099	3.7376		1.6766
H10	3.3648	2.2404	1.0137	3.2477	2.5065	4.2553	3.7376	3.3099	1.6766

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	102.211	C1	S2	O4	107.853
C1	S2	O5	107.853	S2	C1	H6	106.614
S2	C1	H7	108.748	S2	C1	H8	108.748
S2	N3	H9	109.960	S2	N3	H10	109.960
N3	S2	O4	107.570	N3	S2	O5	107.570
O4	S2	O5	122.037	H6	C1	H7	110.643
H6	C1	H8	110.643	H7	C1	H8	111.296
H9	N3	H10	111.582

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: B3PW91/6-311G**

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	-0.477
2	S	0.997
3	N	-0.605
4	O	-0.505
5	O	-0.505
6	H	0.189
7	H	0.177
8	H	0.177
9	H	0.276
10	H	0.276

	x	y	z	Total
	-1.761	3.205	0.000	3.657
CHELPG
AIM
ESP

	x	y	z
x	6.311	0.303	0.000
y	0.303	5.968	0.000
z	0.000	0.000	6.121

<r²>	121.001
(<r²>)^1/2	11.000

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: B3PW91/6-311G**

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)