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	hartrees
Energy at 0K	-322.515519
Energy at 298.15K	-322.521953
HF Energy	-321.544766
Nuclear repulsion energy	273.430685

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3746	3533	64.21
2	A'	3258	3072	4.01
3	A'	3245	3060	12.05
4	A'	3228	3044	7.04
5	A'	3183	3002	25.56
6	A'	1672	1576	18.36
7	A'	1657	1563	24.70
8	A'	1545	1457	24.45
9	A'	1498	1412	110.09
10	A'	1437	1355	1.70
11	A'	1398	1318	26.65
12	A'	1331	1255	59.67
13	A'	1249	1178	44.88
14	A'	1232	1162	123.59
15	A'	1148	1083	6.93
16	A'	1077	1016	1.99
17	A'	1046	986	7.48
18	A'	848	800	6.75
19	A'	634	598	4.07
20	A'	552	520	5.34
21	A'	396	373	14.95
22	A"	920	867	0.02
23	A"	901	850	0.07
24	A"	869	819	0.12
25	A"	778	734	59.71
26	A"	653	616	3.34
27	A"	504	476	0.00
28	A"	407	383	5.28
29	A"	355	334	141.69
30	A"	227	214	0.22

Atom	x (Å)	y (Å)
N1	-1.214	-1.164
C2	-1.185	0.176
C3	0.000	0.922
C4	1.221	0.245
C5	1.196	-1.146
C6	-0.035	-1.808
O7	0.022	2.289
H8	-2.153	0.683
H9	2.149	0.810
H10	2.123	-1.714
H11	-0.083	-2.895
H12	-0.896	2.614

	N1	C2	C3	C4	C5	C6	O7	H8	H9	H10	H11	H12
N1		1.3405	2.4138	2.8128	2.4099	1.3431	3.6676	2.0722	3.8992	3.3815	2.0675	3.7915
C2	1.3405		1.4006	2.4068	2.7239	2.2933	2.4335	1.0923	3.3938	3.8097	3.2628	2.4552
C3	2.4138	1.4006		1.3959	2.3897	2.7306	1.3668	2.1658	2.1518	3.3845	3.8181	1.9144
C4	2.8128	2.4068	1.3959		1.3918	2.4067	2.3694	3.4015	1.0866	2.1566	3.3998	3.1768
C5	2.4099	2.7239	2.3897	1.3918		1.3976	3.6306	3.8159	2.1761	1.0865	2.1662	4.3033
C6	1.3431	2.2933	2.7306	2.4067	1.3976		4.0974	3.2696	3.4093	2.1599	1.0879	4.5052
O7	3.6676	2.4335	1.3668	2.3694	3.6306	4.0974		2.7032	2.5906	4.5205	5.1850	0.9739
H8	2.0722	1.0923	2.1658	3.4015	3.8159	3.2696	2.7032		4.3033	4.9014	4.1337	2.3037
H9	3.8992	3.3938	2.1518	1.0866	2.1761	3.4093	2.5906	4.3033		2.5238	4.3250	3.5392
H10	3.3815	3.8097	3.3845	2.1566	1.0865	2.1599	4.5205	4.9014	2.5238		2.5020	5.2766
H11	2.0675	3.2628	3.8181	3.3998	2.1662	1.0879	5.1850	4.1337	4.3250	2.5020		5.5687
H12	3.7915	2.4552	1.9144	3.1768	4.3033	4.5052	0.9739	2.3037	3.5392	5.2766	5.5687

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	C3	123.418	N1	C2	H8	116.451
N1	C6	C5	123.100	N1	C6	H11	116.135
C2	N1	C6	117.428	C2	C3	C4	118.779
C2	C3	O7	123.120	C3	C2	H8	120.131
C3	C4	C5	118.014	C3	C4	H9	119.658
C3	O7	H12	108.578	C4	C3	O7	118.101
C4	C5	C6	119.260	C4	C5	H10	120.461
C5	C4	H9	122.328	C5	C6	H11	120.765
C6	C5	H10	120.278

All results from a given calculation for C₅H₅NO (3-Pyridinol)

using model chemistry: MP2/6-31G*

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 (3-Pyridinol)

using model chemistry: MP2/6-31G*

States and conformations

All results from a given calculation for C₅H₅NO (3-Pyridinol)