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	hartrees
Energy at 0K	-284.903930
Energy at 298.15K	-284.912057
Nuclear repulsion energy	228.803218

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3701	3540	33.10
2	A	3568	3414	33.25
3	A	3252	3111	11.59
4	A	3173	3036	7.19
5	A	3171	3034	4.29
6	A	3135	3000	9.24
7	A	3070	2937	10.65
8	A	1754	1678	138.29
9	A	1723	1648	87.83
10	A	1667	1595	81.95
11	A	1550	1483	22.74
12	A	1528	1462	14.14
13	A	1493	1428	9.35
14	A	1445	1382	24.60
15	A	1385	1325	103.00
16	A	1264	1209	51.76
17	A	1112	1064	1.59
18	A	1102	1054	4.25
19	A	1053	1007	4.77
20	A	976	934	37.47
21	A	957	915	16.43
22	A	846	810	44.77
23	A	739	707	4.95
24	A	693	663	53.36
25	A	606	580	55.88
26	A	576	551	3.25
27	A	535	512	153.70
28	A	508	486	36.57
29	A	381	364	5.82
30	A	328	313	9.17
31	A	284	271	11.72
32	A	148	142	0.25
33	A	84	80	6.81

Atom	x (Å)	y (Å)	z (Å)
N1	-1.657	0.754	0.244
H2	-2.639	0.517	0.197
H3	-1.384	1.651	0.617
C4	1.643	-0.923	0.229
H5	1.582	-1.271	1.266
H6	1.332	-1.756	-0.408
H7	2.674	-0.640	0.008
C8	1.069	1.474	-0.239
H9	0.353	2.253	-0.479
H10	2.115	1.760	-0.245
C11	-0.742	-0.218	-0.035
O12	-1.054	-1.388	-0.300
C13	0.695	0.218	0.001

	N1	H2	H3	C4	H5	H6	H7	C8	H9	H10	C11	O12	C13
N1		1.0115	1.0092	3.7017	3.9537	3.9569	4.5555	2.8606	2.6094	3.9341	1.3628	2.2901	2.4244
H2	1.0115		1.7427	4.5181	4.7069	4.6154	5.4406	3.8543	3.5243	4.9335	2.0469	2.5271	3.3532
H3	1.0092	1.7427		3.9929	4.2137	4.4762	4.6998	2.6045	2.1408	3.6055	2.0805	3.1911	2.5994
C4	3.7017	4.5181	3.9929		1.0958	1.0932	1.0910	2.5092	3.5003	2.7657	2.5019	2.7877	1.5011
H5	3.9537	4.7069	4.2137	1.0958		1.7605	1.7810	3.1722	4.1196	3.4290	2.8642	3.0681	2.1454
H6	3.9569	4.6154	4.4762	1.0932	1.7605		1.7935	3.2450	4.1268	3.6058	2.6096	2.4171	2.1141
H7	4.5555	5.4406	4.6998	1.0910	1.7810	1.7935		2.6659	3.7407	2.4780	3.4426	3.8145	2.1568
C8	2.8606	3.8543	2.6045	2.5092	3.1722	3.2450	2.6659		1.0847	1.0841	2.4871	3.5640	1.3324
H9	2.6094	3.5243	2.1408	3.5003	4.1196	4.1268	3.7407	1.0847		1.8441	2.7385	3.9068	2.1183
H10	3.9341	4.9335	3.6055	2.7657	3.4290	3.6058	2.4780	1.0841	1.8441		3.4815	4.4671	2.1106
C11	1.3628	2.0469	2.0805	2.5019	2.8642	2.6096	3.4426	2.4871	2.7385	3.4815		1.2395	1.5027
O12	2.2901	2.5271	3.1911	2.7877	3.0681	2.4171	3.8145	3.5640	3.9068	4.4671	1.2395		2.3936
C13	2.4244	3.3532	2.5994	1.5011	2.1454	2.1141	2.1568	1.3324	2.1183	2.1106	1.5027	2.3936

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	H11	H12	123.227	C1	H11	H13	115.485
C2	C1	C3	119.187	C2	C1	H11	118.360
C3	C1	H11	121.886	C4	H13	H8	124.529
C4	H13	H11	112.798	O5	C4	N6	107.076
O5	C4	H7	109.060	O5	C4	H13	110.440
N6	C4	H7	110.392	N6	C4	H13	108.128
H7	C4	H13	111.642	H8	H13	H11	122.516
H9	H8	H10	116.486	H9	H8	H13	122.083
H10	H8	H13	121.380	H12	H11	H13	121.288

All results from a given calculation for C₄H₇NO (Methacrylamide)

using model chemistry: B1B95/3-21G

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	N	-0.792
2	H	0.334
3	H	0.330
4	C	-0.624
5	H	0.229
6	H	0.253
7	H	0.207
8	C	-0.405
9	H	0.194
10	H	0.213
11	C	0.654
12	O	-0.507
13	C	-0.087

	x	y	z	Total
	-0.000	3.213	1.087	3.392
CHELPG
AIM
ESP

	x	y	z
x	7.597	0.357	-0.119
y	0.357	8.822	-0.197
z	-0.119	-0.197	3.496

<r²>	162.520
(<r²>)^1/2	12.748

All results from a given calculation for C4H7NO (Methacrylamide)

using model chemistry: B1B95/3-21G

States and conformations

All results from a given calculation for C₄H₇NO (Methacrylamide)