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	hartrees
Energy at 0K	-174.438314
Energy at 298.15K	-174.448956
Nuclear repulsion energy	138.926082

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3100	2950	49.25
2	A₁	2963	2819	170.00
3	A₁	1521	1447	22.26
4	A₁	1498	1426	1.10
5	A₁	1221	1161	14.42
6	A₁	863	822	20.94
7	A₁	353	336	9.17
8	A₂	3146	2994	0.00
9	A₂	1504	1431	0.00
10	A₂	1076	1024	0.00
11	A₂	262	249	0.00
12	E	3150	2997	43.57
12	E	3150	2997	43.57
13	E	3098	2947	31.07
13	E	3098	2947	31.06
14	E	2949	2806	49.95
14	E	2949	2806	49.96
15	E	1530	1456	8.52
15	E	1530	1456	8.52
16	E	1496	1423	10.95
16	E	1496	1423	10.95
17	E	1455	1384	1.08
17	E	1455	1384	1.08
18	E	1333	1268	14.05
18	E	1333	1268	14.05
19	E	1132	1077	10.82
19	E	1132	1077	10.82
20	E	1086	1034	17.68
20	E	1086	1034	17.68
21	E	424	404	0.04
21	E	424	404	0.04
22	E	276	263	0.68
22	E	276	263	0.68

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.373
C2	0.000	1.380	-0.061
C3	1.195	-0.690	-0.061
C4	-1.195	-0.690	-0.061
H5	0.000	1.493	-1.162
H6	1.293	-0.747	-1.162
H7	-1.293	-0.747	-1.162
H8	-0.884	1.892	0.329
H9	0.884	1.892	0.329
H10	2.080	-0.180	0.329
H11	1.196	-1.711	0.329
H12	-1.196	-1.711	0.329
H13	-2.080	-0.180	0.329
X14	0.000	0.000	1.373

	N1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13	X14
N1		1.4466	1.4466	1.4466	2.1411	2.1411	2.1411	2.0884	2.0884	2.0884	2.0884	2.0884	2.0884	1.0000
C2	1.4466		2.3903	2.3903	1.1066	2.7214	2.7214	1.0934	1.0934	2.6293	3.3377	3.3377	2.6293	1.9901
C3	1.4466	2.3903		2.3903	2.7214	1.1066	2.7214	3.3377	2.6293	1.0934	1.0934	2.6293	3.3377	1.9901
C4	1.4466	2.3903	2.3903		2.7214	2.7214	1.1066	2.6293	3.3377	3.3377	2.6293	1.0934	1.0934	1.9901
H5	2.1411	1.1066	2.7214	2.7214		2.5860	2.5860	1.7786	1.7786	3.0577	3.7313	3.7313	3.0577	2.9417
H6	2.1411	2.7214	1.1066	2.7214	2.5860		2.5860	3.7313	3.0577	1.7786	1.7786	3.0577	3.7313	2.9417
H7	2.1411	2.7214	2.7214	1.1066	2.5860	2.5860		3.0577	3.7313	3.7313	3.0577	1.7786	1.7786	2.9417
H8	2.0884	1.0934	3.3377	2.6293	1.7786	3.7313	3.0577		1.7683	3.6165	4.1604	3.6165	2.3920	2.3343
H9	2.0884	1.0934	2.6293	3.3377	1.7786	3.0577	3.7313	1.7683		2.3920	3.6165	4.1604	3.6165	2.3343
H10	2.0884	2.6293	1.0934	3.3377	3.0577	1.7786	3.7313	3.6165	2.3920		1.7683	3.6165	4.1604	2.3343
H11	2.0884	3.3377	1.0934	2.6293	3.7313	1.7786	3.0577	4.1604	3.6165	1.7683		2.3920	3.6165	2.3343
H12	2.0884	3.3377	2.6293	1.0934	3.7313	3.0577	1.7786	3.6165	4.1604	3.6165	2.3920		1.7683	2.3343
H13	2.0884	2.6293	3.3377	1.0934	3.0577	3.7313	1.7786	2.3920	3.6165	4.1604	3.6165	1.7683		2.3343
X14	1.0000	1.9901	1.9901	1.9901	2.9417	2.9417	2.9417	2.3343	2.3343	2.3343	2.3343	2.3343	2.3343

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H5	113.313	N1	C2	H8	109.832
N1	C2	H9	109.832	N1	C3	H6	113.313
N1	C3	H10	109.832	N1	C3	H11	109.832
N1	C4	H7	113.313	N1	C4	H12	109.832
N1	C4	H13	109.832	C2	N1	C3	111.413
C2	N1	C4	111.413	C2	N1	X14	107.451
C3	N1	C4	111.414	C3	N1	X14	107.451
C4	N1	X14	107.451	H5	C2	H8	107.886
H5	C2	H9	107.886	H6	C3	H10	107.886
H6	C3	H11	107.886	H7	C4	H12	107.886
H7	C4	H13	107.886	H8	C2	H9	107.926
H10	C3	H11	107.926	H12	C4	H13	107.926

All results from a given calculation for N(CH₃)₃ (Trimethylamine)

using model chemistry: mPW1PW91/6-31G**

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	N	-0.416
2	C	-0.227
3	C	-0.227
4	C	-0.227
5	H	0.100
6	H	0.100
7	H	0.100
8	H	0.133
9	H	0.133
10	H	0.133
11	H	0.133
12	H	0.133
13	H	0.133

<r²>	89.679
(<r²>)^1/2	9.470

All results from a given calculation for N(CH3)3 (Trimethylamine)

using model chemistry: mPW1PW91/6-31G**

States and conformations

All results from a given calculation for N(CH₃)₃ (Trimethylamine)