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	hartrees
Energy at 0K	-246.637689
Energy at 298.15K	-246.643945
HF Energy	-246.637689
Nuclear repulsion energy	205.790199

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3250	3130	1.59
2	A₁	3222	3103	6.73
3	A₁	3207	3089	8.91
4	A₁	1623	1564	17.83
5	A₁	1531	1475	11.19
6	A₁	1271	1225	1.36
7	A₁	1124	1083	0.15
8	A₁	1073	1034	9.50
9	A₁	1011	974	4.24
10	A₁	639	616	4.30
11	A₂	1056	1017	0.00
12	A₂	935	901	0.00
13	A₂	396	381	0.00
14	B₁	1075	1036	0.00
15	B₁	999	962	0.12
16	B₁	800	770	4.39
17	B₁	747	720	91.67
18	B₁	436	420	3.76
19	B₂	3240	3121	18.01
20	B₂	3202	3085	19.23
21	B₂	1621	1562	4.06
22	B₂	1495	1440	32.55
23	B₂	1425	1373	0.65
24	B₂	1279	1232	0.85
25	B₂	1223	1178	1.20
26	B₂	1092	1052	0.18
27	B₂	695	670	0.67

Atom	y (Å)	z (Å)
N1	0.000	1.411
C2	0.000	-1.382
C3	1.150	0.725
C4	-1.150	0.725
C5	1.200	-0.671
C6	-1.200	-0.671
H7	0.000	-2.462
H8	2.064	1.300
H9	-2.064	1.300
H10	2.149	-1.187
H11	-2.149	-1.187

	N1	C2	C3	C4	C5	C6	H7	H8	H9	H10	H11
N1		2.7930	1.3389	1.3389	2.4029	2.4029	3.8730	2.0672	2.0672	3.3721	3.3721
C2	2.7930		2.4003	2.4003	1.3945	1.3945	1.0800	3.3845	3.3845	2.1579	2.1579
C3	1.3389	2.4003		2.2996	1.3970	2.7329	3.3880	1.0803	3.2651	2.1579	3.8132
C4	1.3389	2.4003	2.2996		2.7329	1.3970	3.3880	3.2651	1.0803	3.8132	2.1579
C5	2.4029	1.3945	1.3970	2.7329		2.3993	2.1556	2.1525	3.8130	1.0808	3.3883
C6	2.4029	1.3945	2.7329	1.3970	2.3993		2.1556	3.8130	2.1525	3.3883	1.0808
H7	3.8730	1.0800	3.3880	3.3880	2.1556	2.1556		4.2912	4.2912	2.4985	2.4985
H8	2.0672	3.3845	1.0803	3.2651	2.1525	3.8130	4.2912		4.1285	2.4892	4.8929
H9	2.0672	3.3845	3.2651	1.0803	3.8130	2.1525	4.2912	4.1285		4.8929	2.4892
H10	3.3721	2.1579	2.1579	3.8132	1.0808	3.3883	2.4985	2.4892	4.8929		4.2982
H11	3.3721	2.1579	3.8132	2.1579	3.3883	1.0808	2.4985	4.8929	2.4892	4.2982

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C5	122.867	N1	C3	H8	117.011
N1	C4	C6	122.867	N1	C4	H9	117.011
C2	C5	C3	118.607	C2	C5	H10	120.800
C2	C6	C4	118.607	C2	C6	H11	120.800
C3	N1	C4	118.357	C3	C5	H10	120.593
C4	C6	H11	120.593	C5	C2	C6	118.695
C5	C2	H7	120.652	C5	C3	H8	120.122
C6	C2	H7	120.652	C6	C4	H9	120.122

All results from a given calculation for C₅H₅N (Pyridine)

using model chemistry: HSEh1PBE/3-21G

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 C5H5N (Pyridine)

using model chemistry: HSEh1PBE/3-21G

States and conformations

All results from a given calculation for C₅H₅N (Pyridine)