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	hartrees
Energy at 0K	-247.505823
Energy at 298.15K	-247.511903
HF Energy	-246.693868
Nuclear repulsion energy	205.850414

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3240	3066	4.36
2	A₁	3215	3043	11.64
3	A₁	3203	3031	5.91
4	A₁	1693	1603	17.63
5	A₁	1557	1474	5.46
6	A₁	1276	1208	1.67
7	A₁	1122	1062	4.22
8	A₁	1067	1010	4.07
9	A₁	1032	977	7.54
10	A₁	620	586	4.12
11	A₂	976	924	0.00
12	A₂	893	846	0.00
13	A₂	389	368	0.00
14	B₁	951	900	0.06
15	B₁	940	890	0.08
16	B₁	745	705	43.15
17	B₁	692	655	23.69
18	B₁	412	390	3.38
19	B₂	3232	3059	27.43
20	B₂	3202	3031	22.10
21	B₂	1680	1590	4.58
22	B₂	1511	1430	27.83
23	B₂	1414	1338	0.01
24	B₂	1272	1204	0.26
25	B₂	1191	1127	2.93
26	B₂	1109	1050	0.23
27	B₂	675	639	0.53

Atom	y (Å)	z (Å)
N1	0.000	1.423
C2	0.000	-1.387
C3	1.142	0.721
C4	-1.142	0.721
C5	1.196	-0.673
C6	-1.196	-0.673
H7	0.000	-2.475
H8	2.059	1.310
H9	-2.059	1.310
H10	2.157	-1.182
H11	-2.157	-1.182

	N1	C2	C3	C4	C5	C6	H7	H8	H9	H10	H11
N1		2.8098	1.3406	1.3406	2.4134	2.4134	3.8983	2.0618	2.0618	3.3826	3.3826
C2	2.8098		2.3970	2.3970	1.3928	1.3928	1.0885	3.3924	3.3924	2.1666	2.1666
C3	1.3406	2.3970		2.2838	1.3949	2.7219	3.3939	1.0896	3.2543	2.1571	3.8086
C4	1.3406	2.3970	2.2838		2.7219	1.3949	3.3939	3.2543	1.0896	3.8086	2.1571
C5	2.4134	1.3928	1.3949	2.7219		2.3922	2.1630	2.1621	3.8111	1.0876	3.3915
C6	2.4134	1.3928	2.7219	1.3949	2.3922		2.1630	3.8111	2.1621	3.3915	1.0876
H7	3.8983	1.0885	3.3939	3.3939	2.1630	2.1630		4.3085	4.3085	2.5146	2.5146
H8	2.0618	3.3924	1.0896	3.2543	2.1621	3.8111	4.3085		4.1174	2.4941	4.8972
H9	2.0618	3.3924	3.2543	1.0896	3.8111	2.1621	4.3085	4.1174		4.8972	2.4941
H10	3.3826	2.1666	2.1571	3.8086	1.0876	3.3915	2.5146	2.4941	4.8972		4.3139
H11	3.3826	2.1666	3.8086	2.1571	3.3915	1.0876	2.5146	4.8972	2.4941	4.3139

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C5	123.822	N1	C3	H8	115.696
N1	C4	C6	123.822	N1	C4	H9	115.696
C2	C5	C3	118.596	C2	C5	H10	121.239
C2	C6	C4	118.596	C2	C6	H11	121.239
C3	N1	C4	116.811	C3	C5	H10	120.165
C4	C6	H11	120.165	C5	C2	C6	118.353
C5	C2	H7	120.823	C5	C3	H8	120.482
C6	C2	H7	120.823	C6	C4	H9	120.482

All results from a given calculation for C₅H₅N (Pyridine)

using model chemistry: CCD/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 C5H5N (Pyridine)

using model chemistry: CCD/6-31G*

States and conformations

All results from a given calculation for C₅H₅N (Pyridine)