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	hartrees
Energy at 0K	-267.752879
Energy at 298.15K	-267.760087
HF Energy	-266.920039
Nuclear repulsion energy	178.362896

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3819	3629	64.92
2	A'	3184	3025	18.54
3	A'	3098	2943	9.73
4	A'	3093	2939	17.38
5	A'	1841	1749	220.32
6	A'	1523	1447	11.26
7	A'	1482	1408	11.93
8	A'	1445	1373	15.14
9	A'	1428	1356	55.56
10	A'	1325	1259	0.41
11	A'	1189	1129	238.32
12	A'	1109	1054	69.33
13	A'	1030	979	1.87
14	A'	837	795	9.36
15	A'	621	590	20.91
16	A'	473	450	20.53
17	A'	257	244	2.22
18	A"	3189	3030	19.35
19	A"	3143	2987	2.91
20	A"	1518	1442	7.21
21	A"	1298	1233	0.00
22	A"	1124	1068	0.24
23	A"	823	782	12.77
24	A"	652	620	87.80
25	A"	518	492	28.84
26	A"	230	219	0.00
27	A"	46	43	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.570	0.000
C2	-0.606	-0.812	0.000
C3	0.453	-1.908	0.000
O4	-0.962	1.527	0.000
O5	1.181	0.828	0.000
H6	-1.260	-0.883	0.875
H7	-1.260	-0.883	-0.875
H8	-0.017	-2.894	0.000
H9	1.093	-1.824	-0.881
H10	1.093	-1.824	0.881
H11	-0.482	2.366	0.000

	C1	C2	C3	O4	O5	H6	H7	H8	H9	H10	H11
C1		1.5094	2.5190	1.3567	1.2088	2.1131	2.1131	3.4642	2.7757	2.7757	1.8592
C2	1.5094		1.5236	2.3660	2.4256	1.0951	1.0951	2.1633	2.1646	2.1646	3.1806
C3	2.5190	1.5236		3.7145	2.8309	2.1800	2.1800	1.0927	1.0918	1.0918	4.3746
O4	1.3567	2.3660	3.7145		2.2540	2.5808	2.5808	4.5206	4.0284	4.0284	0.9670
O5	1.2088	2.4256	2.8309	2.2540		3.1069	3.1069	3.9101	2.7964	2.7964	2.2647
H6	2.1131	1.0951	2.1800	2.5808	3.1069		1.7504	2.5212	3.0834	2.5344	3.4534
H7	2.1131	1.0951	2.1800	2.5808	3.1069	1.7504		2.5212	2.5344	3.0834	3.4534
H8	3.4642	2.1633	1.0927	4.5206	3.9101	2.5212	2.5212		1.7753	1.7753	5.2803
H9	2.7757	2.1646	1.0918	4.0284	2.7964	3.0834	2.5344	1.7753		1.7621	4.5622
H10	2.7757	2.1646	1.0918	4.0284	2.7964	2.5344	3.0834	1.7753	1.7621		4.5622
H11	1.8592	3.1806	4.3746	0.9670	2.2647	3.4534	3.4534	5.2803	4.5622	4.5622

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	112.303	C1	C2	H6	107.385
C1	C2	H7	107.385	C1	O4	H11	105.040
C2	C1	O4	111.169	C2	C1	O5	125.983
C2	C3	H8	110.476	C2	C3	H9	110.627
C2	C3	H10	110.627	C3	C2	H6	111.664
C3	C2	H7	111.664	O4	C1	O5	122.848
H6	C2	H7	106.102	H8	C3	H9	108.715
H8	C3	H10	108.715	H9	C3	H10	107.598

All results from a given calculation for CH₃CH₂COOH (Propanoic Acid)

using model chemistry: MP2/6-311G**

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 CH3CH2COOH (Propanoic Acid)

using model chemistry: MP2/6-311G**

States and conformations

All results from a given calculation for CH₃CH₂COOH (Propanoic Acid)