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	hartrees
Energy at 0K	-51.285500
Energy at 298.15K	-51.293945
Nuclear repulsion energy	123.511718

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3981	3633	38.35
2	A	3818	3484	45.34
3	A	3386	3090	22.46
4	A	3289	3001	6.82
5	A	3271	2985	17.67
6	A	3244	2960	34.62
7	A	3161	2884	31.54
8	A	1843	1682	139.75
9	A	1807	1649	177.46
10	A	1762	1608	272.07
11	A	1633	1490	15.42
12	A	1616	1475	10.39
13	A	1579	1441	18.29
14	A	1565	1428	4.48
15	A	1510	1378	135.70
16	A	1338	1221	81.40
17	A	1204	1098	5.94
18	A	1191	1087	1.36
19	A	1126	1027	10.32
20	A	1113	1016	58.28
21	A	1028	938	1.64
22	A	889	811	45.17
23	A	793	724	3.90
24	A	741	676	64.28
25	A	636	580	107.94
26	A	611	558	24.96
27	A	544	496	18.97
28	A	540	492	156.49
29	A	400	365	2.33
30	A	354	323	4.04
31	A	282	258	12.54
32	A	176	160	0.18
33	A	75	69	9.46

Atom	x (Å)	y (Å)	z (Å)
N1	-1.724	0.640	0.303
H2	-2.668	0.334	0.252
H3	-1.524	1.532	0.685
C4	1.718	-0.840	0.275
H5	1.562	-1.268	1.261
H6	1.626	-1.649	-0.441
H7	2.723	-0.435	0.228
C8	1.005	1.511	-0.288
H9	0.266	2.250	-0.545
H10	2.029	1.840	-0.293
C11	-0.741	-0.245	-0.054
O12	-1.015	-1.409	-0.386
C13	0.692	0.237	-0.018

	N1	H2	H3	C4	H5	H6	H7	C8	H9	H10	C11	O12	C13
N1		0.9940	0.9905	3.7472	3.9188	4.1248	4.5756	2.9250	2.6967	3.9852	1.3702	2.2752	2.4701
H2	0.9940		1.7124	4.5412	4.6348	4.7804	5.4458	3.8949	3.5941	4.9630	2.0357	2.4859	3.3723
H3	0.9905	1.7124		4.0378	4.2060	4.6153	4.7020	2.7096	2.2877	3.6980	2.0774	3.1707	2.6607
C4	3.7472	4.5412	4.0378		1.0867	1.0836	1.0842	2.5209	3.5116	2.7574	2.5515	2.8685	1.5164
H5	3.9188	4.6348	4.2060	1.0867		1.7457	1.7631	3.2304	4.1618	3.5066	2.8426	3.0614	2.1584
H6	4.1248	4.7804	4.6153	1.0836	1.7457		1.7674	3.2237	4.1303	3.5148	2.7788	2.6520	2.1460
H7	4.5756	5.4458	4.7020	1.0842	1.7631	1.7674		2.6469	3.7208	2.4352	3.4804	3.9108	2.1535
C8	2.9250	3.8949	2.7096	2.5209	3.2304	3.2237	2.6469		1.0761	1.0756	2.4873	3.5518	1.3399
H9	2.6967	3.5941	2.2877	3.5116	4.1618	4.1303	3.7208	1.0761		1.8274	2.7351	3.8801	2.1244
H10	3.9852	4.9630	3.6980	2.7574	3.5066	3.5148	2.4352	1.0756	1.8274		3.4752	4.4529	2.1060
C11	1.3702	2.0357	2.0774	2.5515	2.8426	2.7788	3.4804	2.4873	2.7351	3.4752		1.2409	1.5118
O12	2.2752	2.4859	3.1707	2.8685	3.0614	2.6520	3.9108	3.5518	3.8801	4.4529	1.2409		2.3988
C13	2.4701	3.3723	2.6607	1.5164	2.1584	2.1460	2.1535	1.3399	2.1244	2.1060	1.5118	2.3988

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	H11	H12	121.154	C1	H11	H13	117.903
C2	C1	C3	119.288	C2	C1	H11	117.996
C3	C1	H11	122.463	C4	H13	H8	123.788
C4	H13	H11	114.829	O5	C4	N6	107.092
O5	C4	H7	108.617	O5	C4	H13	110.952
N6	C4	H7	109.232	N6	C4	H13	110.144
H7	C4	H13	110.712	H8	H13	H11	121.317
H9	H8	H10	116.263	H9	H8	H13	122.739
H10	H8	H13	120.961	H12	H11	H13	120.940

All results from a given calculation for C₄H₇NO (Methacrylamide)

using model chemistry: HF/CEP-121G

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	N	-0.658
2	H	0.361
3	H	0.352
4	C	-0.592
5	H	0.163
6	H	0.198
7	H	0.157
8	C	-0.516
9	H	0.166
10	H	0.170
11	C	0.281
12	O	-0.352
13	C	0.268

	x	y	z	Total
	0.596	4.052	1.450	4.345
CHELPG
AIM
ESP

	x	y	z
x	7.563	0.640	-0.149
y	0.640	9.997	-0.235
z	-0.149	-0.235	5.058

<r²>	136.385
(<r²>)^1/2	11.678

All results from a given calculation for C4H7NO (Methacrylamide)

using model chemistry: HF/CEP-121G

States and conformations

All results from a given calculation for C₄H₇NO (Methacrylamide)