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	hartrees
Energy at 0K	-644.393299
Energy at 298.15K	-644.401131
HF Energy	-644.393299
Nuclear repulsion energy	278.469746

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3567	3567	47.18
2	A'	3201	3201	0.02
3	A'	3094	3094	0.02
4	A'	1654	1654	54.52
5	A'	1476	1476	7.99
6	A'	1386	1386	24.52
7	A'	1179	1179	211.64
8	A'	1013	1013	35.79
9	A'	907	907	131.51
10	A'	753	753	12.77
11	A'	679	679	257.90
12	A'	509	509	57.93
13	A'	483	483	14.73
14	A'	300	300	4.91
15	A"	3675	3675	54.61
16	A"	3208	3208	0.00
17	A"	1473	1473	0.76
18	A"	1402	1402	285.06
19	A"	1133	1133	1.29
20	A"	997	997	1.26
21	A"	407	407	0.06
22	A"	335	335	2.83
23	A"	219	219	0.91
24	A"	183	183	41.45

Atom	x (Å)	y (Å)	z (Å)
C1	-1.669	-0.064	0.000
S2	0.108	-0.134	0.000
N3	0.530	1.485	0.000
O4	0.530	-0.695	1.266
O5	0.530	-0.695	-1.266
H6	-2.024	-1.094	0.000
H7	-1.995	0.456	0.898
H8	-1.995	0.456	-0.898
H9	1.048	1.721	0.839
H10	1.048	1.721	-0.839

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.7793	2.6905	2.6154	2.6154	1.0888	1.0873	1.0873	3.3573	3.3573
S2	1.7793		1.6734	1.4472	1.4472	2.3379	2.3619	2.3619	2.2421	2.2421
N3	2.6905	1.6734		2.5207	2.5207	3.6293	2.8710	2.8710	1.0131	1.0131
O4	2.6154	1.4472	2.5207		2.5315	2.8783	2.7995	3.5190	2.5070	3.2452
O5	2.6154	1.4472	2.5207	2.5315		2.8783	3.5190	2.7995	3.2452	2.5070
H6	1.0888	2.3379	3.6293	2.8783	2.8783		1.7910	1.7910	4.2492	4.2492
H7	1.0873	2.3619	2.8710	2.7995	3.5190	1.7910		1.7958	3.2955	3.7246
H8	1.0873	2.3619	2.8710	3.5190	2.7995	1.7910	1.7958		3.7246	3.2955
H9	3.3573	2.2421	1.0131	2.5070	3.2452	4.2492	3.2955	3.7246		1.6773
H10	3.3573	2.2421	1.0131	3.2452	2.5070	4.2492	3.7246	3.2955	1.6773

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	102.338	C1	S2	O4	107.863
C1	S2	O5	107.863	S2	C1	H6	106.714
S2	C1	H7	108.541	S2	C1	H8	108.541
S2	N3	H9	110.731	S2	N3	H10	110.731
N3	S2	O4	107.530	N3	S2	O5	107.530
O4	S2	O5	122.002	H6	C1	H7	110.775
H6	C1	H8	110.775	H7	C1	H8	111.332
H9	N3	H10	111.747

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: M06-2X/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	-0.817
2	S	1.125
3	N	-0.897
4	O	-0.529
5	O	-0.529
6	H	0.292
7	H	0.279
8	H	0.279
9	H	0.398
10	H	0.398

	x	y	z	Total
	-1.788	3.287	0.000	3.742
CHELPG
AIM
ESP

	x	y	z
x	6.068	0.302	0.000
y	0.302	5.749	0.000
z	0.000	0.000	5.939

<r²>	120.456
(<r²>)^1/2	10.975

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: M06-2X/6-311G*

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)