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	hartrees
Energy at 0K	-642.352610
Energy at 298.15K	-642.360273
HF Energy	-642.352610
Nuclear repulsion energy	279.089572

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3435	3398	46.72
2	A'	3106	3073	0.89
3	A'	2996	2964	0.45
4	A'	1495	1479	46.18
5	A'	1370	1355	7.38
6	A'	1267	1253	37.12
7	A'	1152	1139	142.90
8	A'	939	929	47.86
9	A'	864	855	99.64
10	A'	727	719	15.64
11	A'	619	613	212.67
12	A'	487	482	46.56
13	A'	460	455	7.27
14	A'	284	281	4.59
15	A"	3548	3509	61.85
16	A"	3114	3080	0.36
17	A"	1384	1369	74.14
18	A"	1359	1344	149.51
19	A"	1035	1023	0.66
20	A"	917	907	1.90
21	A"	384	380	0.81
22	A"	325	321	2.97
23	A"	216	214	6.25
24	A"	193	191	25.37

Atom	x (Å)	y (Å)	z (Å)
C1	-1.655	-0.067	0.000
S2	0.105	-0.130	0.000
N3	0.527	1.478	0.000
O4	0.527	-0.692	1.268
O5	0.527	-0.692	-1.268
H6	-2.002	-1.107	0.000
H7	-1.987	0.454	0.905
H8	-1.987	0.454	-0.905
H9	1.052	1.697	0.849
H10	1.052	1.697	-0.849

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.7615	2.6737	2.6003	2.6003	1.0970	1.0957	1.0957	3.3402	3.3402
S2	1.7615		1.6623	1.4500	1.4500	2.3231	2.3534	2.3534	2.2254	2.2254
N3	2.6737	1.6623		2.5132	2.5132	3.6169	2.8618	2.8618	1.0217	1.0217
O4	2.6003	1.4500	2.5132		2.5370	2.8599	2.7868	3.5154	2.4808	3.2346
O5	2.6003	1.4500	2.5132	2.5370		2.8599	3.5154	2.7868	3.2346	2.4808
H6	1.0970	2.3231	3.6169	2.8599	2.8599		1.8047	1.8047	4.2320	4.2320
H7	1.0957	2.3534	2.8618	2.7868	3.5154	1.8047		1.8100	3.2836	3.7224
H8	1.0957	2.3534	2.8618	3.5154	2.7868	1.8047	1.8100		3.7224	3.2836
H9	3.3402	2.2254	1.0217	2.4808	3.2346	4.2320	3.2836	3.7224		1.6983
H10	3.3402	2.2254	1.0217	3.2346	2.4808	4.2320	3.7224	3.2836	1.6983

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	102.650	C1	S2	O4	107.735
C1	S2	O5	107.735	S2	C1	H6	106.393
S2	C1	H7	108.660	S2	C1	H8	108.660
S2	N3	H9	109.706	S2	N3	H10	109.706
N3	S2	O4	107.511	N3	S2	O5	107.511
O4	S2	O5	122.041	H6	C1	H7	110.790
H6	C1	H8	110.790	H7	C1	H8	111.375
H9	N3	H10	112.415

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: LSDA/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	-0.338
2	S	0.698
3	N	-0.333
4	O	-0.395
5	O	-0.395
6	H	0.142
7	H	0.136
8	H	0.136
9	H	0.175
10	H	0.175

	x	y	z	Total
	-1.571	2.992	0.000	3.379
CHELPG
AIM
ESP

	x	y	z
x	7.029	0.367	0.000
y	0.367	6.684	0.000
z	0.000	0.000	6.712

<r²>	119.308
(<r²>)^1/2	10.923

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: LSDA/cc-pVTZ

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)