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	hartrees
Energy at 0K	-208.856846
Energy at 298.15K	-208.862713
HF Energy	-208.060164
Nuclear repulsion energy	121.969922

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3774	3552	36.98
2	A	3641	3427	38.07
3	A	3186	2999	5.85
4	A	3141	2957	11.15
5	A	3071	2891	6.07
6	A	1833	1725	324.78
7	A	1650	1553	95.95
8	A	1510	1421	7.42
9	A	1495	1407	9.10
10	A	1431	1347	95.50
11	A	1362	1282	81.76
12	A	1150	1083	0.26
13	A	1074	1011	3.29
14	A	996	938	10.54
15	A	867	816	2.03
16	A	646	608	13.48
17	A	564	530	19.80
18	A	516	486	7.35
19	A	422	397	4.71
20	A	282	265	217.42
21	A	54	51	1.71

Atom	x (Å)	y (Å)	z (Å)
C1	-1.366	-0.299	0.000
C2	0.080	0.156	0.001
N3	0.991	-0.863	-0.032
O4	0.407	1.322	0.004
H5	-2.006	0.575	-0.058
H6	-1.562	-0.955	-0.848
H7	-1.589	-0.853	0.912
H8	1.960	-0.626	0.071
H9	0.716	-1.815	0.107

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5155	2.4236	2.4013	1.0847	1.0904	1.0905	3.3424	2.5779
C2	1.5155		1.3674	1.2104	2.1286	2.1569	2.1527	2.0373	2.0739
N3	2.4236	1.3674		2.2617	3.3243	2.6821	2.7478	1.0028	1.0006
O4	2.4013	1.2104	2.2617		2.5265	3.1281	3.0879	2.4921	3.1535
H5	1.0847	2.1286	3.3243	2.5265		1.7779	1.7757	4.1459	3.6263
H6	1.0904	2.1569	2.6821	3.1281	1.7779		1.7639	3.6551	2.6163
H7	1.0905	2.1527	2.7478	3.0879	1.7757	1.7639		3.6544	2.6249
H8	3.3424	2.0373	1.0028	2.4921	4.1459	3.6551	3.6544		1.7209
H9	2.5779	2.0739	1.0006	3.1535	3.6263	2.6163	2.6249	1.7209

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	114.327	C1	C2	O4	123.115
C2	C1	H5	108.765	C2	C1	H6	110.674
C2	C1	H7	110.327	C2	N3	H8	117.717
C2	N3	H9	121.515	N3	C2	O4	122.543
H5	C1	H6	109.650	H5	C1	H7	109.446
H6	C1	H7	107.964	H8	N3	H9	118.405

All results from a given calculation for CH₃CONH₂ (Acetamide)

using model chemistry: CCSD/cc-pVTZ

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/cc-pVTZ

States and conformations

All results from a given calculation for CH₃CONH₂ (Acetamide)