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	hartrees
Energy at 0K	-246.704612
Energy at 298.15K	-246.711055
Nuclear repulsion energy	207.926810

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3381	3052	4.89
2	A₁	3354	3027	22.15
3	A₁	3341	3016	5.15
4	A₁	1799	1624	40.33
5	A₁	1656	1495	8.06
6	A₁	1342	1211	5.31
7	A₁	1179	1065	3.21
8	A₁	1123	1013	6.86
9	A₁	1093	987	6.20
10	A₁	659	595	5.46
11	A₂	1127	1017	0.00
12	A₂	988	892	0.00
13	A₂	437	394	0.00
14	B₁	1133	1022	0.34
15	B₁	1075	970	0.19
16	B₁	840	758	16.83
17	B₁	778	702	56.44
18	B₁	464	418	4.34
19	B₂	3373	3044	39.18
20	B₂	3341	3016	27.12
21	B₂	1789	1615	19.45
22	B₂	1603	1447	39.35
23	B₂	1502	1356	0.70
24	B₂	1312	1184	0.13
25	B₂	1183	1068	6.34
26	B₂	1159	1046	3.08
27	B₂	720	650	0.33

Atom	y (Å)	z (Å)
N1	0.000	1.400
C2	0.000	-1.372
C3	1.131	0.718
C4	-1.131	0.718
C5	1.190	-0.666
C6	-1.190	-0.666
H7	0.000	-2.448
H8	2.037	1.299
H9	-2.037	1.299
H10	2.140	-1.169
H11	-2.140	-1.169

	N1	C2	C3	C4	C5	C6	H7	H8	H9	H10	H11
N1		2.7725	1.3209	1.3209	2.3846	2.3846	3.8483	2.0396	2.0396	3.3435	3.3435
C2	2.7725		2.3758	2.3758	1.3835	1.3835	1.0759	3.3589	3.3589	2.1493	2.1493
C3	1.3209	2.3758		2.2613	1.3849	2.7017	3.3613	1.0767	3.2206	2.1393	3.7753
C4	1.3209	2.3758	2.2613		2.7017	1.3849	3.3613	3.2206	1.0767	3.7753	2.1393
C5	2.3846	1.3835	1.3849	2.7017		2.3797	2.1426	2.1396	3.7780	1.0746	3.3672
C6	2.3846	1.3835	2.7017	1.3849	2.3797		2.1426	3.7780	2.1396	3.3672	1.0746
H7	3.8483	1.0759	3.3613	3.3613	2.1426	2.1426		4.2646	4.2646	2.4928	2.4928
H8	2.0396	3.3589	1.0767	3.2206	2.1396	3.7780	4.2646		4.0741	2.4696	4.8511
H9	2.0396	3.3589	3.2206	1.0767	3.7780	2.1396	4.2646	4.0741		4.8511	2.4696
H10	3.3435	2.1493	2.1393	3.7753	1.0746	3.3672	2.4928	2.4696	4.8511		4.2793
H11	3.3435	2.1493	3.7753	2.1393	3.3672	1.0746	2.4928	4.8511	2.4696	4.2793

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C5	123.583	N1	C3	H8	116.202
N1	C4	C6	123.583	N1	C4	H9	116.202
C2	C5	C3	118.229	C2	C5	H10	121.426
C2	C6	C4	118.229	C2	C6	H11	121.426
C3	N1	C4	117.735	C3	C5	H10	120.345
C4	C6	H11	120.345	C5	C2	C6	118.639
C5	C2	H7	120.680	C5	C3	H8	120.215
C6	C2	H7	120.680	C6	C4	H9	120.215

All results from a given calculation for C₅H₅N (Pyridine)

using model chemistry: HF/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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Number	Element	Mulliken	CHELPG
1	N	-0.536	-0.691
2	C	-0.090	0.247
3	C	0.128	0.492
4	C	0.128	0.492
5	C	-0.205	-0.466
6	C	-0.205	-0.466
7	H	0.162	0.062
8	H	0.151	0.008
9	H	0.151	0.008
10	H	0.157	0.157
11	H	0.157	0.157

<r²>	119.807
(<r²>)^1/2	10.946

All results from a given calculation for C5H5N (Pyridine)

using model chemistry: HF/6-31G**

States and conformations

All results from a given calculation for C₅H₅N (Pyridine)