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	hartrees
Energy at 0K	-208.687335
Energy at 298.15K	-208.693381
HF Energy	-208.023506
Nuclear repulsion energy	121.407090

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3747	3588	19.26
2	A	3625	3471	22.76
3	A	3169	3034	7.99
4	A	3121	2988	14.76
5	A	3050	2920	7.38
6	A	1831	1753	303.34
7	A	1701	1628	86.82
8	A	1515	1450	10.15
9	A	1507	1443	10.33
10	A	1442	1381	91.24
11	A	1370	1312	94.56
12	A	1175	1125	1.29
13	A	1078	1032	5.02
14	A	1000	957	9.02
15	A	867	830	2.51
16	A	652	624	43.93
17	A	566	542	25.20
18	A	514	493	46.61
19	A	437	418	120.04
20	A	410	392	110.97
21	A	72	69	0.60

Atom	x (Å)	y (Å)	z (Å)
C1	-1.372	-0.301	-0.001
C2	0.079	0.155	-0.006
N3	1.001	-0.869	-0.062
O4	0.408	1.324	0.010
H5	-2.006	0.546	-0.265
H6	-1.540	-1.123	-0.705
H7	-1.648	-0.647	1.004
H8	1.952	-0.605	0.143
H9	0.726	-1.796	0.217

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5208	2.4413	2.4104	1.0912	1.0954	1.0973	3.3410	2.5852
C2	1.5208		1.3793	1.2147	2.1372	2.1773	2.1551	2.0269	2.0671
N3	2.4413	1.3793		2.2726	3.3304	2.6336	2.8645	1.0076	1.0062
O4	2.4104	1.2147	2.2726		2.5515	3.2084	3.0165	2.4738	3.1423
H5	1.0912	2.1372	3.3304	2.5515		1.7886	1.7781	4.1425	3.6310
H6	1.0954	2.1773	2.6336	3.2084	1.7886		1.7768	3.6304	2.5371
H7	1.0973	2.1551	2.8645	3.0165	1.7781	1.7768		3.7019	2.7523
H8	3.3410	2.0269	1.0076	2.4738	4.1425	3.6304	3.7019		1.7106
H9	2.5852	2.0671	1.0062	3.1423	3.6310	2.5371	2.7523	1.7106

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	114.572	C1	C2	O4	123.185
C2	C1	H5	108.704	C2	C1	H6	111.635
C2	C1	H7	109.753	C2	N3	H8	115.361
C2	N3	H9	119.290	N3	C2	O4	122.228
H5	C1	H6	109.765	H5	C1	H7	108.676
H6	C1	H7	108.261	H8	N3	H9	116.304

All results from a given calculation for CH₃CONH₂ (Acetamide)

using model chemistry: QCISD/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 CH3CONH2 (Acetamide)

using model chemistry: QCISD/6-311G*

States and conformations

All results from a given calculation for CH₃CONH₂ (Acetamide)