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	hartrees
Energy at 0K	-211.499970
Energy at 298.15K	-211.511181
HF Energy	-211.026673
Nuclear repulsion energy	185.575122

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3516	3364	0.78
2	A'	3180	3042	46.92
3	A'	3146	3011	22.39
4	A'	3108	2973	34.69
5	A'	3084	2951	25.17
6	A'	3004	2874	94.04
7	A'	1740	1665	25.93
8	A'	1569	1501	3.27
9	A'	1557	1489	2.50
10	A'	1428	1367	23.80
11	A'	1332	1274	6.49
12	A'	1275	1220	0.26
13	A'	1198	1146	2.14
14	A'	1096	1048	11.02
15	A'	963	921	2.12
16	A'	925	885	2.46
17	A'	874	836	7.56
18	A'	742	710	157.81
19	A'	679	650	53.73
20	A'	420	401	5.00
21	A'	200	192	2.20
22	A"	3638	3481	0.21
23	A"	3149	3013	17.59
24	A"	3079	2946	54.89
25	A"	1546	1479	1.62
26	A"	1381	1322	0.68
27	A"	1330	1272	0.42
28	A"	1307	1251	1.20
29	A"	1247	1193	1.27
30	A"	1199	1147	0.42
31	A"	1061	1015	0.00
32	A"	943	902	0.98
33	A"	923	883	2.41
34	A"	801	767	0.28
35	A"	396	379	10.66
36	A"	271	259	40.07

Atom	x (Å)	y (Å)	z (Å)
N1	-1.472	0.799	0.000
H2	-1.884	1.199	0.841
H3	-1.884	1.199	-0.841
C4	0.538	-0.191	-1.091
H5	-0.088	-0.329	-1.981
H6	1.560	0.076	-1.399
C7	0.538	-0.191	1.091
H8	-0.088	-0.329	1.981
H9	1.560	0.076	1.399
C10	0.004	0.802	0.000
H11	0.452	1.812	0.000
C12	0.538	-1.320	0.000
H13	1.374	-2.030	0.000
H14	-0.410	-1.867	0.000

	N1	H2	H3	C4	H5	H6	C7	H8	H9	C10	H11	C12	H13	H14
N1		1.0182	1.0182	2.4926	2.6675	3.4164	2.4926	2.6675	3.4164	1.4757	2.1747	2.9212	4.0134	2.8694
H2	1.0182		1.6818	3.3960	3.6780	4.2589	2.8041	2.6197	3.6651	2.1044	2.5580	3.5945	4.6638	3.5036
H3	1.0182	1.6818		2.8041	2.6197	3.6651	3.3960	3.6780	4.2589	2.1044	2.5580	3.5945	4.6638	3.5036
C4	2.4926	3.3960	2.8041		1.0971	1.0993	2.1824	3.1388	2.7046	1.5693	2.2822	1.5704	2.2964	2.2136
H5	2.6675	3.6780	2.6197	1.0971		1.7935	3.1388	3.9629	3.7821	2.2835	2.9667	2.3022	2.9929	2.5288
H6	3.4164	4.2589	3.6651	1.0993	1.7935		2.7046	3.7821	2.7980	2.2149	2.4893	2.2245	2.5352	3.1002
C7	2.4926	2.8041	3.3960	2.1824	3.1388	2.7046		1.0971	1.0993	1.5693	2.2822	1.5704	2.2964	2.2136
H8	2.6675	2.6197	3.6780	3.1388	3.9629	3.7821	1.0971		1.7935	2.2835	2.9667	2.3022	2.9929	2.5288
H9	3.4164	3.6651	4.2589	2.7046	3.7821	2.7980	1.0993	1.7935		2.2149	2.4893	2.2245	2.5352	3.1002
C10	1.4757	2.1044	2.1044	1.5693	2.2835	2.2149	1.5693	2.2835	2.2149		1.1048	2.1886	3.1467	2.7008
H11	2.1747	2.5580	2.5580	2.2822	2.9667	2.4893	2.2822	2.9667	2.4893	1.1048		3.1330	3.9512	3.7783
C12	2.9212	3.5945	3.5945	1.5704	2.3022	2.2245	1.5704	2.3022	2.2245	2.1886	3.1330		1.0968	1.0951
H13	4.0134	4.6638	4.6638	2.2964	2.9929	2.5352	2.2964	2.9929	2.5352	3.1467	3.9512	1.0968		1.7922
H14	2.8694	3.5036	3.5036	2.2136	2.5288	3.1002	2.2136	2.5288	3.1002	2.7008	3.7783	1.0951	1.7922

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C10	C4	109.845	N1	C10	C7	109.845
N1	C10	H11	114.085	H2	N1	H3	111.364
H2	N1	C10	113.831	H3	N1	C10	113.831
C4	C10	C7	88.108	C4	C10	H11	116.089
C4	C12	C7	88.032	C4	C12	H13	117.755
C4	C12	H14	111.038	H5	C4	H6	109.478
H5	C4	C10	116.715	H5	C4	C12	118.239
H6	C4	C10	110.968	H6	C4	C12	111.648
C7	C10	H11	116.089	C7	C12	H13	117.755
C7	C12	H14	111.038	H8	C7	H9	109.478
H8	C7	C10	116.715	H8	C7	C12	118.239
H9	C7	C10	110.968	H9	C7	C12	111.648
C10	C4	C12	88.388	C10	C7	C12	88.388
H13	C12	H14	109.695

All results from a given calculation for C₄H₉N (Cyclobutylamine)

using model chemistry: MP2/6-31G

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 C4H9N (Cyclobutylamine)

using model chemistry: MP2/6-31G

States and conformations

All results from a given calculation for C₄H₉N (Cyclobutylamine)