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	hartrees
Energy at 0K	-213.104207
Energy at 298.15K	-213.117098
HF Energy	-212.339456
Nuclear repulsion energy	194.734033

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3664	3431	0.03
2	A	3564	3337	0.83
3	A	3231	3026	28.17
4	A	3226	3021	27.16
5	A	3215	3011	34.50
6	A	3212	3008	26.15
7	A	3179	2977	13.58
8	A	3123	2925	21.04
9	A	3122	2924	33.10
10	A	3119	2921	13.22
11	A	3022	2830	67.31
12	A	1697	1590	37.96
13	A	1572	1473	6.70
14	A	1560	1461	2.08
15	A	1559	1460	4.01
16	A	1551	1452	2.09
17	A	1534	1436	0.41
18	A	1473	1380	3.94
19	A	1460	1367	5.96
20	A	1455	1363	9.00
21	A	1431	1340	12.59
22	A	1376	1288	3.74
23	A	1340	1255	1.27
24	A	1294	1212	0.31
25	A	1240	1162	1.31
26	A	1200	1124	9.80
27	A	1108	1038	1.07
28	A	1070	1002	1.99
29	A	1047	980	5.57
30	A	1012	948	1.96
31	A	980	918	15.50
32	A	909	851	108.68
33	A	843	790	2.52
34	A	794	743	1.59
35	A	490	459	7.13
36	A	470	440	6.03
37	A	385	360	0.19
38	A	324	304	36.33
39	A	271	253	3.03
40	A	246	230	8.08
41	A	237	222	10.64
42	A	116	109	1.98

Atom	x (Å)	y (Å)	z (Å)
N1	0.541	1.372	-0.237
H2	-0.226	1.929	0.125
H3	1.386	1.833	0.085
C4	1.778	-0.700	-0.016
H5	1.903	-0.723	-1.098
H6	2.641	-0.192	0.417
H7	1.766	-1.722	0.360
C8	0.485	0.022	0.334
H9	0.385	0.032	1.432
C10	-0.725	-0.717	-0.230
H11	-0.596	-0.799	-1.312
H12	-0.728	-1.731	0.176
C13	-2.057	-0.041	0.080
H14	-2.893	-0.650	-0.261
H15	-2.133	0.924	-0.419
H16	-2.175	0.115	1.153

	N1	H2	H3	C4	H5	H6	H7	C8	H9	C10	H11	H12	C13	H14	H15	H16
N1		1.0146	1.0156	2.4236	2.6432	2.6989	3.3817	1.4676	2.1459	2.4423	2.6760	3.3780	2.9738	3.9849	2.7170	3.2994
H2	1.0146		1.6158	3.3086	3.6140	3.5779	4.1660	2.0462	2.3826	2.7152	3.1052	3.6944	2.6892	3.7296	2.2226	2.8533
H3	1.0156	1.6158		2.5653	2.8639	2.4051	3.5863	2.0383	2.4609	3.3253	3.5790	4.1450	3.9197	4.9594	3.6694	4.0950
C4	2.4236	3.3086	2.5653		1.0894	1.0910	1.0895	1.5213	2.1382	2.5119	2.7059	2.7161	3.8916	4.6772	4.2537	4.2015
H5	2.6432	3.6140	2.8639	1.0894		1.7667	1.7734	2.1484	3.0454	2.7674	2.5089	3.0919	4.1867	4.8687	4.4117	4.7325
H6	2.6989	3.5779	2.4051	1.0910	1.7667		1.7635	2.1676	2.4833	3.4673	3.7190	3.7112	4.7116	5.5936	4.9731	4.8809
H7	3.3817	4.1660	3.5863	1.0895	1.7734	1.7635		2.1641	2.4767	2.7508	3.0378	2.5008	4.1855	4.8210	4.7765	4.4199
C8	1.4676	2.0462	2.0383	1.5213	2.1484	2.1676	2.1641		1.1022	1.5259	2.1335	2.1374	2.5552	3.4952	2.8699	2.7846
H9	2.1459	2.3826	2.4609	2.1382	3.0454	2.4833	2.4767	1.1022		2.1348	3.0303	2.4345	2.7922	3.7521	3.2498	2.5764
C10	2.4423	2.7152	3.3253	2.5119	2.7674	3.4673	2.7508	1.5259	2.1348		1.0923	1.0930	1.5249	2.1690	2.1703	2.1697
H11	2.6760	3.1052	3.5790	2.7059	2.5089	3.7190	3.0378	2.1335	3.0303	1.0923		1.7608	2.1552	2.5305	2.4761	3.0669
H12	3.3780	3.6944	4.1450	2.7161	3.0919	3.7112	2.5008	2.1374	2.4345	1.0930	1.7608		2.1520	2.4591	3.0626	2.5412
C13	2.9738	2.6892	3.9197	3.8916	4.1867	4.7116	4.1855	2.5552	2.7922	1.5249	2.1552	2.1520		1.0892	1.0891	1.0912
H14	3.9849	3.7296	4.9594	4.6772	4.8687	5.5936	4.8210	3.4952	3.7521	2.1690	2.5305	2.4591	1.0892		1.7553	1.7611
H15	2.7170	2.2226	3.6694	4.2537	4.4117	4.9731	4.7765	2.8699	3.2498	2.1703	2.4761	3.0626	1.0891	1.7553		1.7683
H16	3.2994	2.8533	4.0950	4.2015	4.7325	4.8809	4.4199	2.7846	2.5764	2.1697	3.0669	2.5412	1.0912	1.7611	1.7683

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C8	C4	108.351	N1	C8	H9	112.464
N1	C8	C10	109.334	H2	N1	H3	105.479
H2	N1	C8	109.700	H3	N1	C8	108.983
C4	C8	H9	108.119	C4	C8	C10	111.046
H5	C4	H6	108.243	H5	C4	H7	108.955
H5	C4	C8	109.650	H6	C4	H7	107.953
H6	C4	C8	111.076	H7	C4	C8	110.890
C8	C10	H11	108.002	C8	C10	H12	108.266
C8	C10	C13	113.765	H9	C8	C10	107.545
C10	C13	H14	111.049	C10	C13	H15	111.155
C10	C13	H16	110.981	H11	C10	H12	107.359
H11	C10	C13	109.768	H12	C10	C13	109.472
H14	C13	H15	107.376	H14	C13	H16	107.737
H15	C13	H16	108.390

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)