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	hartrees
Energy at 0K	-640.925153
Energy at 298.15K	-640.931741
HF Energy	-640.925153
Nuclear repulsion energy	254.064141

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3147	3130	0.63
2	A'	3116	3099	3.95
3	A'	3032	3015	0.12
4	A'	1573	1564	12.45
5	A'	1464	1456	9.56
6	A'	1321	1314	2.16
7	A'	973	968	47.41
8	A'	937	931	68.97
9	A'	874	869	18.66
10	A'	567	564	96.46
11	A'	491	488	66.30
12	A'	369	367	8.72
13	A'	299	298	29.23
14	A'	222	221	4.76
15	A"	3240	3222	0.57
16	A"	3152	3135	0.01
17	A"	1470	1462	9.83
18	A"	1133	1126	37.63
19	A"	984	978	26.80
20	A"	923	918	0.61
21	A"	260	259	0.48
22	A"	217	216	15.71
23	A"	156	155	46.37
24	A"	120	119	2.31

Atom	x (Å)	y (Å)	z (Å)
C1	-0.555	1.719	0.000
S2	-0.140	-0.159	0.000
N3	1.745	0.079	0.000
O4	-0.555	-0.839	1.396
O5	-0.555	-0.839	-1.396
H6	-1.647	1.810	0.000
H7	-0.097	2.124	0.908
H8	-0.097	2.124	-0.908
H9	2.039	-0.476	0.842
H10	2.039	-0.476	-0.842

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.9229	2.8254	2.9141	2.9141	1.0956	1.0949	1.0949	3.5014	3.5014
S2	1.9229		1.9000	1.6075	1.6075	2.4795	2.4567	2.4567	2.3576	2.3576
N3	2.8254	1.9000		2.8432	2.8432	3.8087	2.8985	2.8985	1.0506	1.0506
O4	2.9141	1.6075	2.8432		2.7915	3.1873	3.0374	3.7812	2.6777	3.4455
O5	2.9141	1.6075	2.8432	2.7915		3.1873	3.7812	3.0374	3.4455	2.6777
H6	1.0956	2.4795	3.8087	3.1873	3.1873		1.8237	1.8237	4.4188	4.4188
H7	1.0949	2.4567	2.8985	3.0374	3.7812	1.8237		1.8167	3.3658	3.7932
H8	1.0949	2.4567	2.8985	3.7812	3.0374	1.8237	1.8167		3.7932	3.3658
H9	3.5014	2.3576	1.0506	2.6777	3.4455	4.4188	3.3658	3.7932		1.6842
H10	3.5014	2.3576	1.0506	3.4455	2.6777	4.4188	3.7932	3.3658	1.6842

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	95.302	C1	S2	O4	110.950
C1	S2	O5	110.950	S2	C1	H6	107.252
S2	C1	H7	105.692	S2	C1	H8	105.692
S2	N3	H9	102.212	S2	N3	H10	102.212
N3	S2	O4	108.022	N3	S2	O5	108.022
O4	S2	O5	120.517	H6	C1	H7	112.719
H6	C1	H8	112.719	H7	C1	H8	112.124
H9	N3	H10	106.553

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: BLYP/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	-0.795
2	S	1.204
3	N	-0.699
4	O	-0.506
5	O	-0.506
6	H	0.241
7	H	0.249
8	H	0.249
9	H	0.281
10	H	0.281

	x	y	z	Total
	1.668	2.284	0.000	2.828
CHELPG
AIM
ESP

	x	y	z
x	6.862	-0.369	0.000
y	-0.369	6.466	0.000
z	0.000	0.000	6.478

<r²>	139.420
(<r²>)^1/2	11.808

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: BLYP/3-21G

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)