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	hartrees
Energy at 0K	-322.636804
Energy at 298.15K	-322.643307
HF Energy	-321.616666
Nuclear repulsion energy	273.471145

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3829	3639	57.50
2	A'	3243	3082	2.87
3	A'	3210	3051	12.25
4	A'	3202	3042	23.17
5	A'	3193	3035	11.38
6	A'	1667	1584	100.90
7	A'	1645	1563	88.23
8	A'	1538	1462	34.24
9	A'	1476	1403	16.97
10	A'	1405	1335	59.35
11	A'	1385	1317	8.39
12	A'	1328	1262	47.55
13	A'	1247	1185	7.84
14	A'	1228	1167	145.85
15	A'	1107	1052	2.76
16	A'	1080	1026	1.66
17	A'	1011	961	12.62
18	A'	847	805	43.75
19	A'	676	642	0.36
20	A'	524	498	0.44
21	A'	406	386	11.63
22	A"	941	894	0.00
23	A"	915	869	0.96
24	A"	847	805	4.62
25	A"	799	759	55.61
26	A"	701	666	1.45
27	A"	532	505	25.24
28	A"	389	369	0.13
29	A"	363	345	135.70
30	A"	223	212	0.67

Atom	x (Å)	y (Å)
N1	0.017	-1.885
C2	-1.126	-1.184
C3	-1.195	0.212
C4	0.000	0.939
C5	1.204	0.229
C6	1.152	-1.164
O7	0.061	2.296
H8	-2.044	-1.768
H9	-2.161	0.714
H10	2.148	0.764
H11	2.077	-1.738
H12	-0.834	2.653

	N1	C2	C3	C4	C5	C6	O7	H8	H9	H10	H11	H12
N1		1.3406	2.4218	2.8233	2.4244	1.3448	4.1813	2.0643	3.3900	3.3999	2.0653	4.6164
C2	1.3406		1.3976	2.4024	2.7246	2.2781	3.6769	1.0886	2.1610	3.8096	3.2504	3.8475
C3	2.4218	1.3976		1.3982	2.3986	2.7206	2.4333	2.1550	1.0882	3.3880	3.8087	2.4670
C4	2.8233	2.4024	1.3982		1.3972	2.3975	1.3592	3.3919	2.1724	2.1549	3.3876	1.9062
C5	2.4244	2.7246	2.3986	1.3972		1.3942	2.3619	3.8130	3.3991	1.0853	2.1520	3.1661
C6	1.3448	2.2781	2.7206	2.3975	1.3942		3.6283	3.2529	3.8078	2.1703	1.0883	4.3024
O7	4.1813	3.6769	2.4333	1.3592	2.3619	3.6283		4.5775	2.7280	2.5887	4.5096	0.9631
H8	2.0643	1.0886	2.1550	3.3919	3.8130	3.2529	4.5775		2.4844	4.8977	4.1212	4.5837
H9	3.3900	2.1610	1.0882	2.1724	3.3991	3.8078	2.7280	2.4844		4.3089	4.8955	2.3499
H10	3.3999	3.8096	3.3880	2.1549	1.0853	2.1703	2.5887	4.8977	4.3089		2.5031	3.5292
H11	2.0653	3.2504	3.8087	3.3876	2.1520	1.0883	4.5096	4.1212	4.8955	2.5031		5.2675
H12	4.6164	3.8475	2.4670	1.9062	3.1661	4.3024	0.9631	4.5837	2.3499	3.5292	5.2675

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	C3	124.353	N1	C2	H8	115.990
N1	C6	C5	124.531	N1	C6	H11	115.778
C2	N1	C6	116.062	C2	C3	C4	118.470
C2	C3	H9	120.249	C3	C2	H8	119.657
C3	C4	C5	118.197	C3	C4	O7	123.872
C4	C3	H9	121.281	C4	C5	C6	118.387
C4	C5	H10	119.946	C4	O7	H12	109.137
C5	C4	O7	117.931	C5	C6	H11	119.690
C6	C5	H10	121.668

All results from a given calculation for C₅H₅NO (4-Pyridinol)

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 C5H5NO (4-Pyridinol)

using model chemistry: MP2/6-311G*

States and conformations

All results from a given calculation for C₅H₅NO (4-Pyridinol)