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	hartrees
Energy at 0K	-213.342182
Energy at 298.15K	-213.354907
HF Energy	-212.410400
Nuclear repulsion energy	200.690772

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3499	3329	0.76
2	A'	3173	3019	34.29
3	A'	3153	3000	55.48
4	A'	3146	2994	3.37
5	A'	3068	2919	3.51
6	A'	3056	2907	21.95
7	A'	1647	1567	29.16
8	A'	1527	1453	9.05
9	A'	1509	1436	3.05
10	A'	1492	1419	0.06
11	A'	1424	1355	5.24
12	A'	1397	1329	17.28
13	A'	1290	1227	14.66
14	A'	1257	1196	24.95
15	A'	1061	1009	6.31
16	A'	976	929	1.56
17	A'	933	888	3.40
18	A'	886	843	130.27
19	A'	761	724	1.75
20	A'	444	423	8.30
21	A'	414	394	0.26
22	A'	335	319	1.22
23	A'	280	266	0.01
24	A"	3595	3421	0.31
25	A"	3170	3016	0.37
26	A"	3150	2997	28.63
27	A"	3145	2993	10.11
28	A"	3064	2916	35.10
29	A"	1518	1445	5.85
30	A"	1497	1425	0.00
31	A"	1487	1415	0.01
32	A"	1405	1337	15.85
33	A"	1356	1291	0.27
34	A"	1136	1081	1.44
35	A"	1018	968	0.81
36	A"	959	913	0.04
37	A"	951	904	0.30
38	A"	446	425	7.47
39	A"	348	331	5.44
40	A"	296	281	5.45
41	A"	273	260	22.52
42	A"	209	199	4.37

Atom	x (Å)	y (Å)	z (Å)
C1	-0.012	0.015	0.000
N2	-0.542	1.380	0.000
C3	1.517	-0.026	0.000
C4	-0.542	-0.680	1.245
C5	-0.542	-0.680	-1.245
H6	-0.201	1.881	-0.813
H7	-0.201	1.881	0.813
H8	1.890	-1.051	0.000
H9	1.909	0.479	-0.884
H10	1.909	0.479	0.884
H11	-0.188	-0.174	2.145
H12	-0.188	-0.174	-2.145
H13	-1.630	-0.662	1.247
H14	-0.202	-1.715	1.285
H15	-1.630	-0.662	-1.247
H16	-0.202	-1.715	-1.285

	C1	N2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
C1		1.4650	1.5288	1.5215	1.5215	2.0438	2.0438	2.1800	2.1643	2.1643	2.1606	2.1606	2.1527	2.1628	2.1527	2.1628
N2	1.4650		2.4932	2.4076	2.4076	1.0133	1.0133	3.4391	2.7567	2.7567	2.6725	2.6725	2.6293	3.3683	2.6293	3.3683
C3	1.5288	2.4932		2.4933	2.4933	2.6917	2.6917	1.0910	1.0908	1.0908	2.7442	2.7442	3.4444	2.7308	3.4444	2.7308
C4	1.5215	2.4076	2.4933		2.4906	3.3028	2.6193	2.7574	3.4471	2.7352	1.0912	3.4461	1.0886	1.0896	2.7197	2.7542
C5	1.5215	2.4076	2.4933	2.4906		2.6193	3.3028	2.7574	2.7352	3.4471	3.4461	1.0912	2.7197	2.7542	1.0886	1.0896
H6	2.0438	1.0133	2.6917	3.3028	2.6193		1.6251	3.6915	2.5337	3.0481	3.6011	2.4488	3.5710	4.1622	2.9494	3.6262
H7	2.0438	1.0133	2.6917	2.6193	3.3028	1.6251		3.6915	3.0481	2.5337	2.4488	3.6011	2.9494	3.6262	3.5710	4.1622
H8	2.1800	3.4391	1.0910	2.7574	2.7574	3.6915	3.6915		1.7672	1.7672	3.1130	3.1130	3.7550	2.5435	3.7550	2.5435
H9	2.1643	2.7567	1.0908	3.4471	2.7352	2.5337	3.0481	1.7672		1.7671	3.7413	2.5331	4.2859	3.7379	3.7365	3.0712
H10	2.1643	2.7567	1.0908	2.7352	3.4471	3.0481	2.5337	1.7672	1.7671		2.5331	3.7413	3.7365	3.0712	4.2859	3.7379
H11	2.1606	2.6725	2.7442	1.0912	3.4461	3.6011	2.4488	3.1130	3.7413	2.5331		4.2901	1.7675	1.7649	3.7181	3.7598
H12	2.1606	2.6725	2.7442	3.4461	1.0912	2.4488	3.6011	3.1130	2.5331	3.7413	4.2901		3.7181	3.7598	1.7675	1.7649
H13	2.1527	2.6293	3.4444	1.0886	2.7197	3.5710	2.9494	3.7550	4.2859	3.7365	1.7675	3.7181		1.7741	2.4942	3.0912
H14	2.1628	3.3683	2.7308	1.0896	2.7542	4.1622	3.6262	2.5435	3.7379	3.0712	1.7649	3.7598	1.7741		3.0912	2.5691
H15	2.1527	2.6293	3.4444	2.7197	1.0886	2.9494	3.5710	3.7550	3.7365	4.2859	3.7181	1.7675	2.4942	3.0912		1.7741
H16	2.1628	3.3683	2.7308	2.7542	1.0896	3.6262	4.1622	2.5435	3.0712	3.7379	3.7598	1.7649	3.0912	2.5691	1.7741

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	109.770	C1	N2	H7	109.770
C1	C3	H8	111.546	C1	C3	H9	110.308
C1	C3	H10	110.308	C1	C4	H11	110.490
C1	C4	H13	110.026	C1	C4	H14	110.770
C1	C5	H12	110.490	C1	C5	H15	110.026
N2	C1	C3	112.754	N2	C1	C4	107.432
N2	C1	C5	107.432	C3	C1	C4	109.649
C3	C1	C5	109.649	C4	C1	C5	109.863
H6	N2	H7	106.622	H8	C3	H9	108.191
H8	C3	H10	108.191	H9	C3	H10	108.196
H11	C4	H13	108.358	H11	C4	H14	108.053
H12	C5	H15	108.358	H13	C4	H14	109.080

All results from a given calculation for C(CH₃)₃NH₂ (2-Propanamine, 2-methyl-)

using model chemistry: MP2/Def2TZVPP

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 C(CH3)3NH2 (2-Propanamine, 2-methyl-)

using model chemistry: MP2/Def2TZVPP

States and conformations

All results from a given calculation for C(CH₃)₃NH₂ (2-Propanamine, 2-methyl-)