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	hartrees
Energy at 0K	-644.362662
Energy at 298.15K	-644.370264
HF Energy	-644.362662
Nuclear repulsion energy	276.784378

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3445	3445	21.52
2	A'	3128	3128	1.90
3	A'	3019	3019	1.27
4	A'	1559	1559	25.76
5	A'	1427	1427	3.35
6	A'	1312	1312	8.02
7	A'	1131	1131	142.18
8	A'	958	958	22.41
9	A'	867	867	81.45
10	A'	693	693	59.60
11	A'	651	651	177.05
12	A'	481	481	31.37
13	A'	458	458	5.86
14	A'	286	286	4.26
15	A"	3555	3555	30.18
16	A"	3136	3136	2.53
17	A"	1428	1428	0.10
18	A"	1358	1358	189.51
19	A"	1075	1075	2.78
20	A"	944	944	1.23
21	A"	383	383	0.23
22	A"	318	318	2.02
23	A"	207	207	2.84
24	A"	168	168	31.92

Atom	x (Å)	y (Å)	z (Å)
C1	-1.682	-0.043	0.000
S2	0.113	-0.141	0.000
N3	0.529	1.504	0.000
O4	0.529	-0.705	1.271
O5	0.529	-0.705	-1.271
H6	-2.051	-1.073	0.000
H7	-2.002	0.485	0.902
H8	-2.002	0.485	-0.902
H9	1.085	1.686	0.833
H10	1.085	1.686	-0.833

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.7976	2.6977	2.6341	2.6341	1.0945	1.0932	1.0932	3.3672	3.3672
S2	1.7976		1.6969	1.4510	1.4510	2.3565	2.3837	2.3837	2.2311	2.2311
N3	2.6977	1.6969		2.5485	2.5485	3.6464	2.8737	2.8737	1.0185	1.0185
O4	2.6341	1.4510	2.5485		2.5416	2.8992	2.8209	3.5416	2.4937	3.2334
O5	2.6341	1.4510	2.5485	2.5416		2.8992	3.5416	2.8209	3.2334	2.4937
H6	1.0945	2.3565	3.6464	2.8992	2.8992		1.8009	1.8009	4.2594	4.2594
H7	1.0932	2.3837	2.8737	2.8209	3.5416	1.8009		1.8042	3.3135	3.7399
H8	1.0932	2.3837	2.8737	3.5416	2.8209	1.8009	1.8042		3.7399	3.3135
H9	3.3672	2.2311	1.0185	2.4937	3.2334	4.2594	3.3135	3.7399		1.6669
H10	3.3672	2.2311	1.0185	3.2334	2.4937	4.2594	3.7399	3.3135	1.6669

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	101.030	C1	S2	O4	107.881
C1	S2	O5	107.881	S2	C1	H6	106.597
S2	C1	H7	108.627	S2	C1	H8	108.627
S2	N3	H9	107.879	S2	N3	H10	107.879
N3	S2	O4	107.862	N3	S2	O5	107.862
O4	S2	O5	122.287	H6	C1	H7	110.810
H6	C1	H8	110.810	H7	C1	H8	111.210
H9	N3	H10	109.834

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: B97D3/6-31G(2df,p)

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	-0.438
2	S	0.452
3	N	-0.509
4	O	-0.277
5	O	-0.277
6	H	0.172
7	H	0.165
8	H	0.165
9	H	0.274
10	H	0.274

	x	y	z	Total
	-1.377	2.673	0.000	3.006
CHELPG
AIM
ESP

	x	y	z
x	6.496	0.390	0.000
y	0.390	6.260	0.000
z	0.000	0.000	6.184

<r²>	120.625
(<r²>)^1/2	10.983

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: B97D3/6-31G(2df,p)

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)