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	hartrees
Energy at 0K	-286.547314
Energy at 298.15K	-286.554961
Nuclear repulsion energy	225.965924

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3603	3596	26.39
2	A	3467	3461	20.74
3	A	3152	3146	12.29
4	A	3068	3062	8.44
5	A	3050	3044	14.49
6	A	3016	3010	11.00
7	A	2960	2955	17.09
8	A	1652	1649	210.16
9	A	1621	1618	112.13
10	A	1558	1555	76.17
11	A	1435	1433	16.53
12	A	1409	1406	8.81
13	A	1394	1391	6.65
14	A	1353	1350	3.81
15	A	1319	1316	82.13
16	A	1186	1184	52.86
17	A	1044	1042	4.03
18	A	1025	1024	0.12
19	A	988	986	6.42
20	A	923	921	4.01
21	A	912	910	34.47
22	A	781	780	7.44
23	A	718	716	3.71
24	A	646	645	6.04
25	A	560	559	10.91
26	A	546	545	5.19
27	A	491	491	4.23
28	A	370	370	4.65
29	A	314	313	15.86
30	A	289	288	117.61
31	A	251	250	37.07
32	A	168	168	0.31
33	A	64	63	4.43

Atom	x (Å)	y (Å)	z (Å)
N1	-1.687	0.753	0.289
H2	-2.662	0.464	0.325
H3	-1.419	1.603	0.777
C4	1.683	-0.919	0.283
H5	1.487	-1.370	1.275
H6	1.560	-1.730	-0.458
H7	2.723	-0.551	0.256
C8	1.089	1.467	-0.294
H9	0.371	2.252	-0.561
H10	2.150	1.747	-0.311
C11	-0.754	-0.216	-0.041
O12	-1.093	-1.361	-0.374
C13	0.705	0.202	-0.004

	N1	H2	H3	C4	H5	H6	H7	C8	H9	H10	C11	O12	C13
N1		1.0181	1.0162	3.7612	3.9434	4.1544	4.5985	2.9246	2.6842	4.0083	1.3845	2.2938	2.4715
H2	1.0181		1.7456	4.5603	4.6355	4.8221	5.4808	3.9318	3.6306	5.0205	2.0590	2.5069	3.3934
H3	1.0162	1.7456		4.0280	4.1871	4.6373	4.6978	2.7303	2.3273	3.7338	2.1022	3.1968	2.6617
C4	3.7612	4.5603	4.0280		1.1070	1.1053	1.1034	2.5251	3.5331	2.7706	2.5566	2.8870	1.5148
H5	3.9434	4.6355	4.1871	1.1070		1.7711	1.7987	3.2658	4.2107	3.5591	2.8437	3.0625	2.1721
H6	4.1544	4.8221	4.6373	1.1053	1.7711		1.8030	3.2353	4.1562	3.5294	2.7961	2.6796	2.1605
H7	4.5985	5.4808	4.6978	1.1034	1.7987	1.8030		2.6544	3.7489	2.4355	3.5055	3.9518	2.1698
C8	2.9246	3.9318	2.7303	2.5251	3.2658	3.2353	2.6544		1.0964	1.0974	2.5078	3.5731	1.3534
H9	2.6842	3.6306	2.3273	3.5331	4.2107	4.1562	3.7489	1.0964		1.8655	2.7608	3.9030	2.1501
H10	4.0083	5.0205	3.7338	2.7706	3.5591	3.5294	2.4355	1.0974	1.8655		3.5148	4.4925	2.1376
C11	1.3845	2.0590	2.1022	2.5566	2.8437	2.7961	3.5055	2.5078	2.7608	3.5148		1.2407	1.5175
O12	2.2938	2.5069	3.1968	2.8870	3.0625	2.6796	3.9518	3.5731	3.9030	4.4925	1.2407		2.4112
C13	2.4715	3.3934	2.6617	1.5148	2.1721	2.1605	2.1698	1.3534	2.1501	2.1376	1.5175	2.4112

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	H11	H12	121.703	C1	H11	H13	116.711
C2	C1	C3	118.205	C2	C1	H11	117.139
C3	C1	H11	121.485	C4	H13	H8	123.284
C4	H13	H11	114.945	O5	C4	N6	106.368
O5	C4	H7	108.923	O5	C4	H13	110.929
N6	C4	H7	109.433	N6	C4	H13	110.110
H7	C4	H13	110.960	H8	H13	H11	121.639
H9	H8	H10	116.503	H9	H8	H13	122.374
H10	H8	H13	121.077	H12	H11	H13	121.574

All results from a given calculation for C₄H₇NO (Methacrylamide)

using model chemistry: BLYP/aug-cc-pVDZ

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	0.208
2	H	-0.122
3	H	-0.133
4	C	0.693
5	H	-0.179
6	H	-0.180
7	H	-0.427
8	C	1.339
9	H	-0.794
10	H	-0.799
11	C	0.401
12	O	-0.568
13	C	0.560

	x	y	z	Total
	0.452	3.039	1.409	3.380
CHELPG
AIM
ESP

	x	y	z
x	11.105	0.316	-0.235
y	0.316	11.887	-0.072
z	-0.235	-0.072	7.273

<r²>	167.840
(<r²>)^1/2	12.955

All results from a given calculation for C4H7NO (Methacrylamide)

using model chemistry: BLYP/aug-cc-pVDZ

States and conformations

All results from a given calculation for C₄H₇NO (Methacrylamide)