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	hartrees
Energy at 0K	-212.710860
Energy at 298.15K	-212.723606
HF Energy	-212.228948
Nuclear repulsion energy	192.248750

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3639	3482	0.02
2	A	3520	3368	0.85
3	A	3156	3020	35.59
4	A	3143	3008	42.35
5	A	3135	3000	44.49
6	A	3133	2998	32.53
7	A	3102	2968	12.25
8	A	3054	2922	4.19
9	A	3053	2921	51.12
10	A	3046	2915	25.09
11	A	2930	2803	82.69
12	A	1744	1669	41.49
13	A	1584	1516	7.44
14	A	1575	1507	4.17
15	A	1572	1504	3.60
16	A	1566	1499	3.50
17	A	1553	1486	0.58
18	A	1479	1415	3.27
19	A	1477	1413	7.54
20	A	1457	1394	5.99
21	A	1437	1375	22.86
22	A	1400	1339	4.11
23	A	1348	1289	1.74
24	A	1296	1240	1.39
25	A	1244	1190	3.14
26	A	1201	1149	2.78
27	A	1089	1042	4.26
28	A	1064	1018	4.07
29	A	1043	998	2.95
30	A	1029	984	2.91
31	A	957	916	5.07
32	A	850	814	15.49
33	A	795	761	12.83
34	A	745	713	171.79
35	A	492	471	11.22
36	A	469	449	6.80
37	A	385	368	0.63
38	A	288	275	26.80
39	A	265	254	5.36
40	A	236	226	1.99
41	A	221	212	32.02
42	A	109	104	3.63

Atom	x (Å)	y (Å)	z (Å)
N1	0.570	1.393	-0.208
H2	-0.218	1.985	0.044
H3	1.452	1.857	0.001
C4	1.794	-0.726	-0.013
H5	1.922	-0.744	-1.104
H6	2.666	-0.222	0.432
H7	1.768	-1.757	0.365
C8	0.490	0.015	0.339
H9	0.379	0.008	1.445
C10	-0.741	-0.709	-0.252
H11	-0.611	-0.753	-1.345
H12	-0.742	-1.745	0.126
C13	-2.092	-0.040	0.089
H14	-2.932	-0.645	-0.281
H15	-2.171	0.953	-0.376
H16	-2.210	0.073	1.178

	N1	H2	H3	C4	H5	H6	H7	C8	H9	C10	H11	H12	C13	H14	H15	H16
N1		1.0175	1.0186	2.4545	2.6826	2.7218	3.4183	1.4845	2.1653	2.4780	2.7005	3.4175	3.0377	4.0520	2.7809	3.3747
H2	1.0175		1.6752	3.3764	3.6531	3.6517	4.2485	2.1137	2.4956	2.7609	3.0958	3.7678	2.7596	3.7931	2.2486	2.9846
H3	1.0186	1.6752		2.6055	2.8652	2.4455	3.6464	2.1057	2.5801	3.3855	3.5894	4.2196	4.0208	5.0553	3.7529	4.2396
C4	2.4545	3.3764	2.6055		1.0984	1.1006	1.0990	1.5412	2.1611	2.5466	2.7493	2.7368	3.9477	4.7341	4.3208	4.2531
H5	2.6826	3.6531	2.8652	1.0984		1.7846	1.7910	2.1703	3.0736	2.7961	2.5444	3.1002	4.2464	4.9239	4.4898	4.7901
H6	2.7218	3.6517	2.4455	1.1006	1.7846		1.7801	2.1911	2.5121	3.5088	3.7650	3.7449	4.7735	5.6583	5.0420	4.9409
H7	3.4183	4.2485	3.6464	1.0990	1.7910	1.7801		2.1853	2.4926	2.7878	3.0964	2.5206	4.2335	4.8720	4.8376	4.4532
C8	1.4845	2.1137	2.1057	1.5412	2.1703	2.1911	2.1853		1.1122	1.5455	2.1531	2.1586	2.5941	3.5388	2.9097	2.8271
H9	2.1653	2.4956	2.5801	2.1611	3.0736	2.5121	2.4926	1.1122		2.1567	3.0568	2.4635	2.8190	3.7899	3.2725	2.6030
C10	2.4780	2.7609	3.3855	2.5466	2.7961	3.5088	2.7878	1.5455	2.1567		1.1009	1.1028	1.5460	2.1917	2.1959	2.1943
H11	2.7005	3.0958	3.5894	2.7493	2.5444	3.7650	3.0964	2.1531	3.0568	1.1009		1.7790	2.1814	2.5552	2.5063	3.0987
H12	3.4175	3.7678	4.2196	2.7368	3.1002	3.7449	2.5206	2.1586	2.4635	1.1028	1.7790		2.1755	2.4843	3.0940	2.5626
C13	3.0377	2.7596	4.0208	3.9477	4.2464	4.7735	4.2335	2.5941	2.8190	1.5460	2.1814	2.1755		1.0989	1.0989	1.1008
H14	4.0520	3.7931	5.0553	4.7341	4.9239	5.6583	4.8720	3.5388	3.7899	2.1917	2.5552	2.4843	1.0989		1.7721	1.7787
H15	2.7809	2.2486	3.7529	4.3208	4.4898	5.0420	4.8376	2.9097	3.2725	2.1959	2.5063	3.0940	1.0989	1.7721		1.7857
H16	3.3747	2.9846	4.2396	4.2531	4.7901	4.9409	4.4532	2.8271	2.6030	2.1943	3.0987	2.5626	1.1008	1.7787	1.7857

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C8	C4	108.416	N1	C8	H9	112.209
N1	C8	C10	109.717	H2	N1	H3	110.728
H2	N1	C8	114.005	H3	N1	C8	113.228
C4	C8	H9	107.974	C4	C8	C10	111.180
H5	C4	H6	108.496	H5	C4	H7	109.194
H5	C4	C8	109.471	H6	C4	H7	108.049
H6	C4	C8	110.967	H7	C4	C8	110.613
C8	C10	H11	107.712	C8	C10	H12	108.022
C8	C10	C13	114.090	H9	C8	C10	107.356
C10	C13	H14	110.782	C10	C13	H15	111.115
C10	C13	H16	110.875	H11	C10	H12	107.660
H11	C10	C13	109.855	H12	C10	C13	109.294
H14	C13	H15	107.472	H14	C13	H16	107.918
H15	C13	H16	108.548

All results from a given calculation for CH₃C(NH₂)HCH₂CH₃ (2-Butanamine)

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 CH3C(NH2)HCH2CH3 (2-Butanamine)

using model chemistry: MP2/6-31G

States and conformations

All results from a given calculation for CH₃C(NH₂)HCH₂CH₃ (2-Butanamine)