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	hartrees
Energy at 0K	-41.138407
Energy at 298.15K	-41.144467
Nuclear repulsion energy	103.049632

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3196	3086	7.91
2	A₁	3165	3057	15.63
3	A₁	3154	3046	3.59
4	A₁	1632	1576	25.48
5	A₁	1499	1448	3.24
6	A₁	1232	1190	4.58
7	A₁	1081	1044	8.68
8	A₁	1033	997	2.04
9	A₁	994	960	5.76
10	A₁	596	576	2.69
11	A₂	1013	979	0.00
12	A₂	913	882	0.00
13	A₂	384	371	0.00
14	B₁	1033	998	0.04
15	B₁	972	938	0.04
16	B₁	763	737	60.92
17	B₁	724	700	52.09
18	B₁	410	396	3.24
19	B₂	3188	3078	36.72
20	B₂	3147	3039	38.28
21	B₂	1624	1568	9.53
22	B₂	1459	1408	29.30
23	B₂	1363	1316	0.01
24	B₂	1315	1270	0.06
25	B₂	1148	1109	1.87
26	B₂	1068	1031	0.15
27	B₂	645	623	0.72

Atom	y (Å)	z (Å)
N1	0.000	1.450
C2	0.000	-1.400
C3	1.151	0.743
C4	-1.151	0.743
C5	1.216	-0.675
C6	-1.216	-0.675
H7	0.000	-2.495
H8	2.076	1.334
H9	-2.076	1.334
H10	2.185	-1.183
H11	-2.185	-1.183

	N1	C2	C3	C4	C5	C6	H7	H8	H9	H10	H11
N1		2.8505	1.3504	1.3504	2.4488	2.4488	3.9456	2.0796	2.0796	3.4215	3.4215
C2	2.8505		2.4330	2.4330	1.4159	1.4159	1.0951	3.4337	3.4337	2.1957	2.1957
C3	1.3504	2.4330		2.3013	1.4202	2.7595	3.4372	1.0983	3.2807	2.1864	3.8518
C4	1.3504	2.4330	2.3013		2.7595	1.4202	3.4372	3.2807	1.0983	3.8518	2.1864
C5	2.4488	1.4159	1.4202	2.7595		2.4324	2.1891	2.1861	3.8574	1.0937	3.4388
C6	2.4488	1.4159	2.7595	1.4202	2.4324		2.1891	3.8574	2.1861	3.4388	1.0937
H7	3.9456	1.0951	3.4372	3.4372	2.1891	2.1891		4.3565	4.3565	2.5488	2.5488
H8	2.0796	3.4337	1.0983	3.2807	2.1861	3.8574	4.3565		4.1527	2.5198	4.9493
H9	2.0796	3.4337	3.2807	1.0983	3.8574	2.1861	4.3565	4.1527		4.9493	2.5198
H10	3.4215	2.1957	2.1864	3.8518	1.0937	3.4388	2.5488	2.5198	4.9493		4.3698
H11	3.4215	2.1957	3.8518	2.1864	3.4388	1.0937	2.5488	4.9493	2.5198	4.3698

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C5	124.202	N1	C3	H8	115.884
N1	C4	C6	124.202	N1	C4	H9	115.884
C2	C5	C3	118.157	C2	C5	H10	121.539
C2	C6	C4	118.157	C2	C6	H11	121.539
C3	N1	C4	116.885	C3	C5	H10	120.304
C4	C6	H11	120.304	C5	C2	C6	118.396
C5	C2	H7	120.802	C5	C3	H8	119.914
C6	C2	H7	120.802	C6	C4	H9	119.914

All results from a given calculation for C₅H₅N (Pyridine)

using model chemistry: B3LYP/CEP-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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Number	Element	Mulliken
1	N	0.355
2	C	-0.540
3	C	-0.630
4	C	-0.630
5	C	0.019
6	C	0.019
7	H	0.298
8	H	0.241
9	H	0.241
10	H	0.313
11	H	0.313

<r²>	100.778
(<r²>)^1/2	10.039

All results from a given calculation for C5H5N (Pyridine)

using model chemistry: B3LYP/CEP-31G*

States and conformations

All results from a given calculation for C₅H₅N (Pyridine)