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	hartrees
Energy at 0K	-246.726150
Energy at 298.15K	-246.731977
HF Energy	-245.874290
Nuclear repulsion energy	162.687154

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3776	3576	32.08
2	A	3640	3448	45.37
3	A	3301	3126	2.46
4	A	3209	3039	11.26
5	A	3192	3023	3.81
6	A	1813	1717	239.19
7	A	1701	1611	30.02
8	A	1688	1599	90.19
9	A	1466	1388	98.82
10	A	1377	1304	61.64
11	A	1311	1242	60.02
12	A	1143	1082	7.84
13	A	1064	1008	3.76
14	A	1010	956	39.03
15	A	948	898	22.87
16	A	835	791	8.62
17	A	809	766	30.02
18	A	629	596	29.59
19	A	604	572	12.62
20	A	478	453	6.61
21	A	472	447	76.31
22	A	388	367	209.23
23	A	284	269	6.16
24	A	98	93	4.47

Atom	x (Å)	y (Å)	z (Å)
C1	-0.797	-0.656	-0.021
C2	0.477	0.130	-0.005
N3	1.613	-0.640	-0.040
O4	0.511	1.349	-0.004
C5	-1.975	-0.025	0.019
H6	-0.746	-1.741	-0.071
H7	2.479	-0.154	0.130
H8	1.574	-1.607	0.230
H9	-2.003	1.059	0.060
H10	-2.914	-0.567	0.007

	C1	C2	N3	O4	C5	H6	H7	H8	H9	H10
C1		1.4970	2.4102	2.3936	1.3377	1.0876	3.3171	2.5672	2.0980	2.1195
C2	1.4970		1.3726	1.2199	2.4579	2.2363	2.0258	2.0678	2.6495	3.4624
N3	2.4102	1.3726		2.2748	3.6417	2.6036	1.0070	1.0048	3.9968	4.5283
O4	2.3936	1.2199	2.2748		2.8405	3.3366	2.4801	3.1507	2.5311	3.9242
C5	1.3377	2.4579	3.6417	2.8405		2.1133	4.4575	3.8924	1.0846	1.0839
H6	1.0876	2.2363	2.6036	3.3366	2.1133		3.5997	2.3435	3.0720	2.4673
H7	3.3171	2.0258	1.0070	2.4801	4.4575	3.5997		1.7147	4.6435	5.4101
H8	2.5672	2.0678	1.0048	3.1507	3.8924	2.3435	1.7147		4.4648	4.6130
H9	2.0980	2.6495	3.9968	2.5311	1.0846	3.0720	4.6435	4.4648		1.8641
H10	2.1195	3.4624	4.5283	3.9242	1.0839	2.4673	5.4101	4.6130	1.8641

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	114.188	C1	C2	O4	123.211
C1	C5	H9	119.658	C1	C5	H10	121.800
C2	C1	C5	120.141	C2	C1	H6	118.968
C2	N3	H7	115.852	C2	N3	H8	120.066
N3	C2	O4	122.562	C5	C1	H6	120.889
H7	N3	H8	116.930	H9	C5	H10	118.542

All results from a given calculation for CH₂CHCONH₂ (Acrylamide)

using model chemistry: MP2=FULL/6-311G*

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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All results from a given calculation for CH2CHCONH2 (Acrylamide)

using model chemistry: MP2=FULL/6-311G*

States and conformations

All results from a given calculation for CH₂CHCONH₂ (Acrylamide)