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	hartrees
Energy at 0K	-247.802017
Energy at 298.15K	-247.810370
HF Energy	-247.032952
Nuclear repulsion energy	178.032604

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3744	3566	32.62
2	A	3600	3429	31.49
3	A	3208	3055	14.84
4	A	3198	3046	18.24
5	A	3135	2986	11.01
6	A	3100	2953	18.74
7	A	3079	2932	21.34
8	A	1817	1731	216.15
9	A	1619	1542	94.71
10	A	1499	1428	11.40
11	A	1492	1421	6.03
12	A	1464	1394	5.44
13	A	1427	1359	50.78
14	A	1409	1342	30.60
15	A	1289	1228	26.37
16	A	1286	1225	51.64
17	A	1142	1088	2.67
18	A	1098	1046	0.12
19	A	1087	1035	3.87
20	A	1015	967	2.86
21	A	821	782	9.12
22	A	812	773	5.80
23	A	620	590	26.95
24	A	609	580	12.00
25	A	495	471	33.34
26	A	455	433	15.31
27	A	387	369	188.69
28	A	260	247	8.44
29	A	224	213	0.20
30	A	43	40	1.08

Atom	x (Å)	y (Å)	z (Å)
H1	-2.585	0.012	0.092
H2	-1.790	-1.508	0.198
N3	-1.756	-0.541	-0.104
O4	-0.496	1.363	0.033
C5	-0.559	0.140	0.013
H6	0.641	-1.336	1.001
H7	0.594	-1.503	-0.758
C8	0.673	-0.761	0.056
H9	2.845	-0.632	0.012
H10	2.012	0.590	-0.995
H11	2.033	0.774	0.769
C12	1.971	0.036	-0.045

	H1	H2	N3	O4	C5	H6	H7	C8	H9	H10	H11	C12
H1		1.7194	1.0161	2.4878	2.0321	3.6127	3.6226	3.3491	5.4690	4.7586	4.7293	4.5579
H2	1.7194		1.0140	3.1533	2.0659	2.5659	2.5684	2.5782	4.7211	4.5034	4.4893	4.0727
N3	1.0161	1.0140		2.2865	1.3822	2.7561	2.6216	2.4442	4.6033	4.0332	4.1045	3.7712
O4	2.4878	3.1533	2.2865		1.2244	3.0843	3.1663	2.4244	3.8916	2.8184	2.6992	2.8024
C5	2.0321	2.0659	1.3822	1.2244		2.1433	2.1496	1.5266	3.4901	2.7971	2.7732	2.5320
H6	3.6127	2.5659	2.7561	3.0843	2.1433		1.7682	1.1067	2.5165	3.0941	2.5389	2.1780
H7	3.6226	2.5684	2.6216	3.1663	2.1496	1.7682		1.1049	2.5344	2.5393	3.0969	2.1849
C8	3.3491	2.5782	2.4442	2.4244	1.5266	1.1067	1.1049		2.1762	2.1728	2.1711	1.5257
H9	5.4690	4.7211	4.6033	3.8916	3.4901	2.5165	2.5344	2.1762		1.7895	1.7913	1.1016
H10	4.7586	4.5034	4.0332	2.8184	2.7971	3.0941	2.5393	2.1728	1.7895		1.7732	1.1010
H11	4.7293	4.4893	4.1045	2.6992	2.7732	2.5389	3.0969	2.1711	1.7913	1.7732		1.1004
C12	4.5579	4.0727	3.7712	2.8024	2.5320	2.1780	2.1849	1.5257	1.1016	1.1010	1.1004

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	N3	H2	115.765	H1	N3	C5	114.989
H2	N3	C5	118.314	N3	C5	O4	122.497
N3	C5	C8	114.244	O4	C5	C8	123.215
C5	C8	H6	107.894	C5	C8	H7	108.485
C5	C8	C12	112.102	H6	C8	H7	106.167
H6	C8	C12	110.648	H7	C8	C12	111.304
C8	C12	H9	110.813	C8	C12	H10	110.581
C8	C12	H11	110.480	H9	C12	H10	108.676
H9	C12	H11	108.877	H10	C12	H11	107.319

All results from a given calculation for C₃H₇NO (Propanamide)

using model chemistry: MP2/cc-pVDZ

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/cc-pVDZ

States and conformations

All results from a given calculation for C₃H₇NO (Propanamide)