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	hartrees
Energy at 0K	-641.253415
Energy at 298.15K	-641.261080
HF Energy	-641.253415
Nuclear repulsion energy	276.990945

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3491	3358	36.69
2	A'	3159	3039	2.36
3	A'	3078	2961	1.16
4	A'	1629	1567	59.37
5	A'	1525	1467	7.54
6	A'	1437	1382	16.72
7	A'	1166	1122	173.66
8	A'	1033	993	32.24
9	A'	906	872	204.69
10	A'	740	712	50.35
11	A'	510	490	98.40
12	A'	474	456	30.04
13	A'	408	392	230.95
14	A'	303	291	0.64
15	A"	3621	3484	45.57
16	A"	3170	3049	3.03
17	A"	1529	1471	3.58
18	A"	1406	1352	201.37
19	A"	1059	1019	3.97
20	A"	1003	965	0.00
21	A"	422	406	0.88
22	A"	333	321	1.90
23	A"	244	234	0.01
24	A"	177	170	11.15

Atom	x (Å)	y (Å)	z (Å)
C1	-1.666	-0.060	0.000
S2	0.118	-0.136	0.000
N3	0.541	1.460	0.000
O4	0.541	-0.704	1.279
O5	0.541	-0.704	-1.279
H6	-2.056	-1.082	0.000
H7	-2.013	0.461	0.894
H8	-2.013	0.461	-0.894
H9	0.873	1.867	0.870
H10	0.873	1.867	-0.870

	C1	S2	N3	O4	O5	H6	H7	H8	H9	H10
C1		1.7857	2.6802	2.6310	2.6310	1.0933	1.0918	1.0918	3.3046	3.3046
S2	1.7857		1.6512	1.4622	1.4622	2.3706	2.3868	2.3868	2.3108	2.3108
N3	2.6802	1.6512		2.5140	2.5140	3.6339	2.8845	2.8845	1.0164	1.0164
O4	2.6310	1.4622	2.5140		2.5584	2.9192	2.8334	3.5502	2.6247	3.3677
O5	2.6310	1.4622	2.5140	2.5584		2.9192	3.5502	2.8334	3.3677	2.6247
H6	1.0933	2.3706	3.6339	2.9192	2.9192		1.7840	1.7840	4.2465	4.2465
H7	1.0918	2.3868	2.8845	2.8334	3.5502	1.7840		1.7887	3.2105	3.6633
H8	1.0918	2.3868	2.8845	3.5502	2.8334	1.7840	1.7887		3.6633	3.2105
H9	3.3046	2.3108	1.0164	2.6247	3.3677	4.2465	3.2105	3.6633		1.7403
H10	3.3046	2.3108	1.0164	3.3677	2.6247	4.2465	3.6633	3.2105	1.7403

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	N3	102.418	C1	S2	O4	107.786
C1	S2	O5	107.786	S2	C1	H6	108.447
S2	C1	H7	109.727	S2	C1	H8	109.727
S2	N3	H9	118.087	S2	N3	H10	118.087
N3	S2	O4	107.547	N3	S2	O5	107.547
O4	S2	O5	122.050	H6	C1	H7	109.455
H6	C1	H8	109.455	H7	C1	H8	110.004
H9	N3	H10	117.756

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)

using model chemistry: B3LYP/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	-0.830
2	S	1.243
3	N	-0.816
4	O	-0.475
5	O	-0.475
6	H	0.239
7	H	0.229
8	H	0.229
9	H	0.328
10	H	0.328

	x	y	z	Total
	-1.671	3.660	0.000	4.024
CHELPG
AIM
ESP

	x	y	z
x	4.794	0.349	0.000
y	0.349	5.040	0.000
z	0.000	0.000	5.253

<r²>	120.743
(<r²>)^1/2	10.988

All results from a given calculation for CH3SO2NH2 (methanesulfonamide)

using model chemistry: B3LYP/3-21G*

States and conformations

All results from a given calculation for CH₃SO₂NH₂ (methanesulfonamide)