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	hartrees
Energy at 0K	-642.140353
Energy at 298.15K	-642.147526
HF Energy	-642.140353
Nuclear repulsion energy	261.151661

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3777	3401	79.82
2	A'	3412	3072	0.15
3	A'	3274	2948	2.64
4	A'	1739	1566	33.88
5	A'	1594	1435	15.33
6	A'	1526	1374	0.11
7	A'	1158	1043	24.23
8	A'	923	831	132.17
9	A'	778	700	35.76
10	A'	634	571	97.11
11	A'	574	517	221.19
12	A'	376	339	58.95
13	A'	340	306	36.23
14	A'	266	240	11.73
15	A"	3938	3546	105.46
16	A"	3423	3082	0.34
17	A"	1604	1444	16.29
18	A"	1236	1113	21.73
19	A"	1141	1027	2.57
20	A"	850	765	0.32
21	A"	342	308	1.78
22	A"	279	251	6.69
23	A"	204	184	24.29
24	A"	189	170	0.02

Atom	x (Å)	y (Å)	z (Å)
C1	-1.737	-0.063	0.000
S2	0.091	-0.114	0.000
N3	0.572	1.519	0.000
O4	0.572	-0.744	1.424
O5	0.572	-0.744	-1.424
H6	-2.066	-1.087	0.000
H7	-2.044	0.452	0.893
H8	-2.044	0.452	-0.893
H9	0.982	1.833	0.856
H10	0.982	1.833	-0.856

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.8283	2.7991	2.7975	2.7975	1.0764	1.0752	1.0752	3.4232	3.4232
S2	1.8283		1.7031	1.6300	1.6300	2.3659	2.3824	2.3824	2.3062	2.3062
N3	2.7991	1.7031		2.6741	2.6741	3.7088	2.9636	2.9636	0.9994	0.9994
O4	2.7975	1.6300	2.6741		2.8482	3.0177	2.9260	3.6941	2.6703	3.4650
O5	2.7975	1.6300	2.6741	2.8482		3.0177	3.6941	2.9260	3.4650	2.6703
H6	1.0764	2.3659	3.7088	3.0177	3.0177		1.7797	1.7797	4.3070	4.3070
H7	1.0752	2.3824	2.9636	2.9260	3.6941	1.7797		1.7852	3.3269	3.7582
H8	1.0752	2.3824	2.9636	3.6941	2.9260	1.7797	1.7852		3.7582	3.3269
H9	3.4232	2.3062	0.9994	2.6703	3.4650	4.3070	3.3269	3.7582		1.7119
H10	3.4232	2.3062	0.9994	3.4650	2.6703	4.3070	3.7582	3.3269	1.7119

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	104.810	C1	S2	O4	107.846
C1	S2	O5	107.846	S2	C1	H6	106.171
S2	C1	H7	107.423	S2	C1	H8	107.423
S2	N3	H9	114.634	S2	N3	H10	114.634
N3	S2	O4	106.678	N3	S2	O5	106.678
O4	S2	O5	121.775	H6	C1	H7	111.611
H6	C1	H8	111.611	H7	C1	H8	112.230
H9	N3	H10	117.837

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: HF/SDD

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	-0.631
2	S	1.475
3	N	-0.976
4	O	-0.737
5	O	-0.737
6	H	0.273
7	H	0.254
8	H	0.254
9	H	0.412
10	H	0.412

	x	y	z	Total
	-3.370	4.450	0.000	5.582
CHELPG
AIM
ESP

	x	y	z
x	5.712	0.250	0.000
y	0.250	5.694	0.000
z	0.000	0.000	6.890

<r²>	133.950
(<r²>)^1/2	11.574

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: HF/SDD

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)