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	hartrees
Energy at 0K	-284.902878
Energy at 298.15K	-284.911177
Nuclear repulsion energy	229.716642

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3950	3597	46.02
2	A	3813	3473	48.84
3	A	3391	3088	10.08
4	A	3305	3010	6.05
5	A	3271	2978	15.96
6	A	3247	2957	21.68
7	A	3181	2896	23.25
8	A	1921	1749	402.19
9	A	1836	1672	91.15
10	A	1759	1602	116.24
11	A	1594	1451	20.26
12	A	1572	1432	8.79
13	A	1554	1415	12.09
14	A	1532	1395	22.20
15	A	1491	1357	82.81
16	A	1326	1207	62.03
17	A	1197	1090	8.96
18	A	1157	1053	0.59
19	A	1101	1003	9.59
20	A	1075	979	40.10
21	A	1018	927	2.89
22	A	901	821	25.19
23	A	803	731	5.20
24	A	738	672	12.94
25	A	622	566	19.48
26	A	585	533	21.77
27	A	546	498	5.13
28	A	409	372	44.94
29	A	383	349	150.98
30	A	353	321	5.48
31	A	283	257	13.62
32	A	197	180	0.21
33	A	70	63	4.57

Atom	x (Å)	y (Å)	z (Å)
N1	-1.686	0.717	0.261
H2	-2.623	0.387	0.339
H3	-1.435	1.510	0.805
C4	1.683	-0.892	0.268
H5	2.699	-0.504	0.272
H6	1.480	-1.359	1.232
H7	1.596	-1.669	-0.489
C8	1.046	1.463	-0.274
H9	0.320	2.226	-0.519
H10	2.085	1.760	-0.288
C11	-0.747	-0.222	-0.045
O12	-1.048	-1.342	-0.353
C13	0.696	0.211	-0.008

	N1	H2	H3	C4	H5	H6	H7	C8	H9	H10	C11	O12	C13
N1		0.9965	0.9938	3.7335	4.5523	3.9091	4.1265	2.8819	2.6286	3.9507	1.3624	2.2420	2.4496
H2	0.9965		1.7001	4.4923	5.3969	4.5481	4.7657	3.8721	3.5750	4.9439	2.0089	2.4395	3.3413
H3	0.9938	1.7001		3.9723	4.6296	4.1128	4.5791	2.7056	2.3121	3.6942	2.0479	3.1029	2.6244
C4	3.7335	4.4923	3.9723		1.0881	1.0906	1.0884	2.4995	3.4919	2.7389	2.5402	2.8363	1.5058
H5	4.5523	5.3969	4.6296	1.0881		1.7723	1.7760	2.6273	3.7058	2.4113	3.4726	3.8902	2.1458
H6	3.9091	4.5481	4.1128	1.0906	1.7723		1.7530	3.2290	4.1548	3.5221	2.8084	2.9842	2.1494
H7	4.1265	4.7657	4.5791	1.0884	1.7760	1.7530		3.1875	4.0981	3.4691	2.7898	2.6671	2.1394
C8	2.8819	3.8721	2.7056	2.4995	2.6273	3.2290	3.1875		1.0800	1.0808	2.4711	3.5013	1.3272
H9	2.6286	3.5750	2.3121	3.4919	3.7058	4.1548	4.0981	1.0800		1.8393	2.7118	3.8247	2.1117
H10	3.9507	4.9439	3.6942	2.7389	2.4113	3.5221	3.4691	1.0808	1.8393		3.4649	4.4089	2.0991
C11	1.3624	2.0089	2.0479	2.5402	3.4726	2.8084	2.7898	2.4711	2.7118	3.4649		1.2005	1.5069
O12	2.2420	2.4395	3.1029	2.8363	3.8902	2.9842	2.6671	3.5013	3.8247	4.4089	1.2005		2.3604
C13	2.4496	3.3413	2.6244	1.5058	2.1458	2.1494	2.1394	1.3272	2.1117	2.0991	1.5069	2.3604

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	H11	H12	121.905	C1	H11	H13	117.155
C2	C1	C3	117.338	C2	C1	H11	115.912
C3	C1	H11	119.902	C4	H13	H8	123.714
C4	H13	H11	114.952	O5	C4	N6	108.865
O5	C4	H7	109.366	O5	C4	H13	110.600
N6	C4	H7	107.118	N6	C4	H13	110.740
H7	C4	H13	110.073	H8	H13	H11	121.237
H9	H8	H10	116.689	H9	H8	H13	122.297
H10	H8	H13	120.984	H12	H11	H13	120.927

All results from a given calculation for C₄H₇NO (Methacrylamide)

using model chemistry: HF/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	-0.181
2	H	-0.016
3	H	-0.028
4	C	0.238
5	H	-0.128
6	H	0.076
7	H	0.084
8	C	1.069
9	H	-0.407
10	H	-0.386
11	C	0.591
12	O	-0.809
13	C	-0.102

	x	y	z	Total
	0.627	3.223	1.594	3.650
CHELPG
AIM
ESP

	x	y	z
x	0.000	0.000	0.000
y	0.000	0.000	0.000
z	0.000	0.000	0.000

<r²>	163.314
(<r²>)^1/2	12.779

All results from a given calculation for C4H7NO (Methacrylamide)

using model chemistry: HF/aug-cc-pVDZ

States and conformations

All results from a given calculation for C₄H₇NO (Methacrylamide)