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	hartrees
Energy at 0K	-208.612590
Energy at 298.15K	-208.618498
HF Energy	-207.973867
Nuclear repulsion energy	121.357417

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3732	3544	30.67
2	A	3609	3428	33.81
3	A	3206	3045	5.57
4	A	3152	2993	11.50
5	A	3082	2927	6.08
6	A	1859	1766	285.86
7	A	1676	1592	103.34
8	A	1534	1457	9.09
9	A	1529	1453	8.93
10	A	1462	1389	89.36
11	A	1390	1320	87.15
12	A	1169	1110	0.37
13	A	1090	1036	5.92
14	A	1012	961	7.50
15	A	876	832	1.42
16	A	645	612	31.12
17	A	565	536	21.77
18	A	518	492	28.09
19	A	427	406	11.02
20	A	347	330	263.26
21	A	44	42	0.25

Atom	x (Å)	y (Å)	z (Å)
C1	-1.371	-0.296	0.000
C2	0.080	0.155	0.001
N3	0.990	-0.872	-0.033
O4	0.415	1.329	0.005
H5	-2.008	0.588	-0.057
H6	-1.576	-0.952	-0.855
H7	-1.603	-0.852	0.917
H8	1.968	-0.634	0.071
H9	0.718	-1.833	0.111

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5197	2.4302	2.4141	1.0913	1.0969	1.0971	3.3563	2.5956
C2	1.5197		1.3724	1.2198	2.1329	2.1685	2.1650	2.0471	2.0913
N3	2.4302	1.3724		2.2744	3.3342	2.6958	2.7613	1.0113	1.0097
O4	2.4141	1.2198	2.2744		2.5335	3.1471	3.1076	2.5036	3.1780
H5	1.0913	2.1329	3.3342	2.5335		1.7875	1.7854	4.1608	3.6495
H6	1.0969	2.1685	2.6958	3.1471	1.7875		1.7747	3.6764	2.6402
H7	1.0971	2.1650	2.7613	3.1076	1.7854	1.7747		3.6758	2.6452
H8	3.3563	2.0471	1.0113	2.5036	4.1608	3.6764	3.6758		1.7325
H9	2.5956	2.0913	1.0097	3.1780	3.6495	2.6402	2.6452	1.7325

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	114.240	C1	C2	O4	123.200
C2	C1	H5	108.434	C2	C1	H6	110.902
C2	C1	H7	110.615	C2	N3	H8	117.557
C2	N3	H9	122.039	N3	C2	O4	122.546
H5	C1	H6	109.550	H5	C1	H7	109.344
H6	C1	H7	107.978	H8	N3	H9	118.020

All results from a given calculation for CH₃CONH₂ (Acetamide)

using model chemistry: CCSD=FULL/6-31G*

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: CCSD=FULL/6-31G*

States and conformations

All results from a given calculation for CH₃CONH₂ (Acetamide)