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	hartrees
Energy at 0K	-46.685260
Energy at 298.15K	-46.693616
HF Energy	-45.945093
Nuclear repulsion energy	99.577389

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3724	3548	28.24
2	A	3582	3413	33.92
3	A	3196	3045	17.05
4	A	3171	3022	31.65
5	A	3135	2987	16.68
6	A	3078	2933	20.36
7	A	3074	2929	27.80
8	A	1757	1674	276.80
9	A	1662	1584	80.27
10	A	1541	1469	12.69
11	A	1535	1462	7.91
12	A	1511	1440	5.82
13	A	1447	1378	3.98
14	A	1429	1361	72.09
15	A	1312	1250	22.23
16	A	1297	1236	76.26
17	A	1147	1093	3.88
18	A	1117	1064	2.72
19	A	1071	1020	10.26
20	A	1021	973	1.96
21	A	820	782	8.06
22	A	805	767	2.86
23	A	669	637	8.24
24	A	602	574	57.84
25	A	510	486	26.31
26	A	432	412	25.49
27	A	407	388	203.95
28	A	258	246	10.02
29	A	225	214	0.08
30	A	34	32	3.92

Atom	x (Å)	y (Å)	z (Å)
H1	-2.576	-0.068	-0.220
H2	-1.738	-1.560	-0.009
N3	-1.700	-0.579	-0.256
O4	-0.587	1.392	0.122
C5	-0.570	0.156	0.077
H6	0.796	-0.762	1.424
H7	0.577	-1.678	-0.076
C8	0.694	-0.669	0.334
H9	2.839	-0.546	-0.009
H10	1.854	0.093	-1.342
H11	2.027	1.032	0.149
C12	1.936	0.021	-0.253

	H1	H2	N3	O4	C5	H6	H7	C8	H9	H10	H11	C12
H1		1.7246	1.0150	2.4910	2.0397	3.8146	3.5433	3.3699	5.4403	4.5724	4.7467	4.5123
H2	1.7246		1.0127	3.1718	2.0774	3.0183	2.3189	2.6125	4.6882	4.1726	4.5739	4.0068
N3	1.0150	1.0127		2.2951	1.3881	3.0139	2.5346	2.4666	4.5458	3.7760	4.0802	3.6844
O4	2.4910	3.1718	2.2951		1.2375	2.8719	3.2897	2.4353	3.9385	3.1286	2.6384	2.8953
C5	2.0397	2.0774	1.3881	1.2375		2.1263	2.1687	1.5305	3.4821	2.8098	2.7421	2.5310
H6	3.8146	3.0183	3.0139	2.8719	2.1263		1.7712	1.0983	2.5048	3.0824	2.5223	2.1735
H7	3.5433	2.3189	2.5346	3.2897	2.1687	1.7712		1.0963	2.5306	2.5238	3.0823	2.1827
C8	3.3699	2.6125	2.4666	2.4353	1.5305	1.0983	1.0963		2.1764	2.1764	2.1692	1.5372
H9	5.4403	4.6882	4.5458	3.9385	3.4821	2.5048	2.5306	2.1764		1.7771	1.7823	1.0946
H10	4.5724	4.1726	3.7760	3.1286	2.8098	3.0824	2.5238	2.1764	1.7771		1.7707	1.0946
H11	4.7467	4.5739	4.0802	2.6384	2.7421	2.5223	3.0823	2.1692	1.7823	1.7707		1.0921
C12	4.5123	4.0068	3.6844	2.8953	2.5310	2.1735	2.1827	1.5372	1.0946	1.0946	1.0921

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	N3	H2	116.536	H1	N3	C5	115.284
H2	N3	C5	119.009	N3	C5	O4	121.784
N3	C5	C8	115.291	O4	C5	C8	122.892
C5	C8	H6	106.820	C5	C8	H7	110.208
C5	C8	C12	111.192	H6	C8	H7	107.628
H6	C8	C12	110.000	H7	C8	C12	110.849
C8	C12	H9	110.447	C8	C12	H10	110.446
C8	C12	H11	110.028	H9	C12	H10	108.530
H9	C12	H11	109.187	H10	C12	H11	108.149

All results from a given calculation for C₃H₇NO (Propanamide)

using model chemistry: MP2/CEP-121G*

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 C3H7NO (Propanamide)

using model chemistry: MP2/CEP-121G*

States and conformations

All results from a given calculation for C₃H₇NO (Propanamide)