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	hartrees
Energy at 0K	-37.501088
Energy at 298.15K	-37.512630
HF Energy	-36.854746
Nuclear repulsion energy	105.990721

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3530	3351	0.21
2	A'	3200	3038	73.21
3	A'	3144	2984	17.60
4	A'	3121	2963	51.38
5	A'	3021	2868	134.46
6	A'	1557	1478	1.02
7	A'	1533	1455	6.15
8	A'	1414	1342	1.26
9	A'	1345	1276	1.80
10	A'	1264	1200	0.36
11	A'	1251	1187	8.23
12	A'	1095	1039	0.70
13	A'	1022	971	8.56
14	A'	961	913	0.73
15	A'	932	884	36.31
16	A'	917	871	42.84
17	A'	784	744	12.50
18	A'	582	552	39.03
19	A'	310	294	5.25
20	A"	3180	3020	2.57
21	A"	3136	2977	49.28
22	A"	3110	2953	31.12
23	A"	3021	2868	53.92
24	A"	1540	1462	0.46
25	A"	1510	1434	1.10
26	A"	1446	1373	5.54
27	A"	1352	1284	13.78
28	A"	1297	1231	10.36
29	A"	1265	1201	6.44
30	A"	1203	1142	1.16
31	A"	1138	1080	8.40
32	A"	1097	1042	0.53
33	A"	954	906	0.96
34	A"	879	835	2.53
35	A"	626	594	0.66
36	A"	82	78	0.21

Atom	x (Å)	y (Å)	z (Å)
N1	0.582	-1.091	0.000
H2	0.450	-2.110	0.000
C3	-0.102	-0.475	1.161
C4	-0.102	-0.475	-1.161
C5	-0.102	1.032	0.783
C6	-0.102	1.032	-0.783
H7	-1.149	-0.836	1.279
H8	-1.149	-0.836	-1.279
H9	0.451	-0.682	2.094
H10	0.451	-0.682	-2.094
H11	0.810	1.517	1.169
H12	0.810	1.517	-1.169
H13	-0.977	1.555	1.206
H14	-0.977	1.555	-1.206

	N1	H2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14
N1		1.0270	1.4818	1.4818	2.3637	2.3637	2.1666	2.1666	2.1378	2.1378	2.8667	2.8667	3.2992	3.2992
H2	1.0270		2.0801	2.0801	3.2843	3.2843	2.4112	2.4112	2.5345	2.5345	3.8269	3.8269	4.1133	4.1133
C3	1.4818	2.0801		2.3226	1.5531	2.4597	1.1135	2.6796	1.1043	3.3087	2.1901	3.1978	2.2105	3.2385
C4	1.4818	2.0801	2.3226		2.4597	1.5531	2.6796	1.1135	3.3087	1.1043	3.1978	2.1901	3.2385	2.2105
C5	2.3637	3.2843	1.5531	2.4597		1.5663	2.1975	2.9724	2.2277	3.3946	1.1026	2.2084	1.1039	2.2351
C6	2.3637	3.2843	2.4597	1.5531	1.5663		2.9724	2.1975	3.3946	2.2277	2.2084	1.1026	2.2351	1.1039
H7	2.1666	2.4112	1.1135	2.6796	2.1975	2.9724		2.5577	1.8022	3.7364	3.0630	3.9193	2.3977	3.4521
H8	2.1666	2.4112	2.6796	1.1135	2.9724	2.1975	2.5577		3.7364	1.8022	3.9193	3.0630	3.4521	2.3977
H9	2.1378	2.5345	1.1043	3.3087	2.2277	3.3946	1.8022	3.7364		4.1885	2.4124	3.9511	2.7989	4.2350
H10	2.1378	2.5345	3.3087	1.1043	3.3946	2.2277	3.7364	1.8022	4.1885		3.9511	2.4124	4.2350	2.7989
H11	2.8667	3.8269	2.1901	3.1978	1.1026	2.2084	3.0630	3.9193	2.4124	3.9511		2.3377	1.7883	2.9725
H12	2.8667	3.8269	3.1978	2.1901	2.2084	1.1026	3.9193	3.0630	3.9511	2.4124	2.3377		2.9725	1.7883
H13	3.2992	4.1133	2.2105	3.2385	1.1039	2.2351	2.3977	3.4521	2.7989	4.2350	1.7883	2.9725		2.4117
H14	3.2992	4.1133	3.2385	2.2105	2.2351	1.1039	3.4521	2.3977	4.2350	2.7989	2.9725	1.7883	2.4117

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C5	102.283	N1	C3	H7	112.416
N1	C3	H9	110.665	N1	C4	C6	102.283
N1	C4	H8	112.416	N1	C4	H10	110.665
H2	N1	C3	110.705	H2	N1	C4	110.705
C3	N1	C4	103.201	C3	C5	C6	104.092
C3	C5	H11	109.951	C3	C5	H13	111.485
C4	C6	C5	104.092	C4	C6	H12	109.951
C4	C6	H14	111.485	C5	C3	H7	109.894
C5	C3	H9	112.835	C5	C6	H12	110.477
C5	C6	H14	112.515	C6	C4	H8	109.894
C6	C4	H10	112.835	C6	C5	H11	110.477
C6	C5	H13	112.515	H7	C3	H9	108.701
H8	C4	H10	108.701	H11	C5	H13	108.290
H12	C6	H14	108.290

All results from a given calculation for C₄H₉N (Pyrrolidine)

using model chemistry: MP2/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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All results from a given calculation for C4H9N (Pyrrolidine)

using model chemistry: MP2/CEP-31G*

States and conformations

All results from a given calculation for C₄H₉N (Pyrrolidine)