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	hartrees
Energy at 0K	-208.763754
Energy at 298.15K	-208.769512
HF Energy	-208.001998
Nuclear repulsion energy	122.049971

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3820	3591	50.51
2	A	3673	3453	51.52
3	A	3257	3061	2.11
4	A	3213	3020	4.58
5	A	3125	2937	3.22
6	A	1833	1723	262.03
7	A	1635	1537	100.02
8	A	1527	1435	7.87
9	A	1511	1420	10.93
10	A	1431	1345	98.29
11	A	1364	1282	69.38
12	A	1137	1069	0.77
13	A	1075	1011	4.00
14	A	995	935	7.44
15	A	868	816	1.45
16	A	658	618	8.72
17	A	557	523	16.31
18	A	535	503	4.96
19	A	418	393	3.26
20	A	196	184	213.45
21	A	60	57	0.94

Atom	x (Å)	y (Å)	z (Å)
C1	-1.364	-0.279	0.000
C2	0.084	0.158	0.001
N3	0.967	-0.882	-0.031
O4	0.432	1.319	0.004
H5	-1.990	0.605	-0.057
H6	-1.572	-0.931	-0.848
H7	-1.597	-0.829	0.912
H8	1.942	-0.666	0.070
H9	0.675	-1.831	0.103

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5117	2.4076	2.4036	1.0844	1.0896	1.0897	3.3293	2.5644
C2	1.5117		1.3649	1.2125	2.1218	2.1554	2.1508	2.0343	2.0776
N3	2.4076	1.3649		2.2659	3.3097	2.6674	2.7319	1.0042	1.0019
O4	2.4036	1.2125	2.2659		2.5256	3.1308	3.0906	2.4954	3.1614
H5	1.0844	2.1218	3.3097	2.5256		1.7767	1.7743	4.1343	3.6139
H6	1.0896	2.1554	2.6674	3.1308	1.7767		1.7627	3.6418	2.6010
H7	1.0897	2.1508	2.7319	3.0906	1.7743	1.7627		3.6412	2.6110
H8	3.3293	2.0343	1.0042	2.4954	4.1343	3.6418	3.6412		1.7220
H9	2.5644	2.0776	1.0019	3.1614	3.6139	2.6010	2.6110	1.7220

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	113.544	C1	C2	O4	123.478
C2	C1	H5	108.510	C2	C1	H6	110.860
C2	C1	H7	110.490	C2	N3	H8	117.523
C2	N3	H9	122.002	N3	C2	O4	122.964
H5	C1	H6	109.619	H5	C1	H7	109.388
H6	C1	H7	107.959	H8	N3	H9	118.261

All results from a given calculation for CH₃CONH₂ (Acetamide)

using model chemistry: MP2=FULL/6-31G(2df,p)

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 CH3CONH2 (Acetamide)

using model chemistry: MP2=FULL/6-31G(2df,p)

States and conformations

All results from a given calculation for CH₃CONH₂ (Acetamide)