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	hartrees
Energy at 0K	-174.383039
Energy at 298.15K	-174.393493
Nuclear repulsion energy	136.962696

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2986	2980	38.46
2	A₁	2827	2822	233.14
3	A₁	1438	1435	23.84
4	A₁	1419	1416	0.39
5	A₁	1152	1150	24.99
6	A₁	794	792	23.94
7	A₁	354	354	8.83
8	A₂	3026	3020	0.00
9	A₂	1421	1418	0.00
10	A₂	1027	1025	0.00
11	A₂	230	229	0.00
12	E	3030	3024	44.64
12	E	3030	3024	44.62
13	E	2982	2977	33.83
13	E	2982	2977	33.84
14	E	2809	2804	63.51
14	E	2809	2804	63.50
15	E	1444	1441	8.19
15	E	1444	1441	8.19
16	E	1417	1414	7.57
16	E	1417	1414	7.53
17	E	1376	1373	1.16
17	E	1376	1373	1.16
18	E	1247	1244	11.12
18	E	1247	1244	11.13
19	E	1072	1070	7.53
19	E	1072	1070	7.53
20	E	1011	1009	20.29
20	E	1011	1009	20.30
21	E	412	412	0.00
21	E	412	412	0.00
22	E	258	258	0.64
22	E	258	258	0.64

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.376
C2	0.000	1.403	-0.061
C3	1.215	-0.701	-0.061
C4	-1.215	-0.701	-0.061
H5	0.000	1.512	-1.177
H6	1.310	-0.756	-1.177
H7	-1.310	-0.756	-1.177
H8	-0.896	1.915	0.334
H9	0.896	1.915	0.334
H10	2.107	-0.182	0.334
H11	1.211	-1.733	0.334
H12	-1.211	-1.733	0.334
H13	-2.107	-0.182	0.334
X14	0.000	0.000	1.376

	N1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13	X14
N1		1.4695	1.4695	1.4695	2.1673	2.1673	2.1673	2.1148	2.1148	2.1148	2.1148	2.1148	2.1148	1.0000
C2	1.4695		2.4301	2.4301	1.1206	2.7607	2.7607	1.1050	1.1050	2.6657	3.3851	3.3851	2.6657	2.0084
C3	1.4695	2.4301		2.4301	2.7607	1.1206	2.7607	3.3851	2.6657	1.1050	1.1050	2.6657	3.3851	2.0084
C4	1.4695	2.4301	2.4301		2.7607	2.7607	1.1206	2.6657	3.3851	3.3851	2.6657	1.1050	1.1050	2.0084
H5	2.1673	1.1206	2.7607	2.7607		2.6196	2.6196	1.8018	1.8018	3.0969	3.7793	3.7793	3.0969	2.9668
H6	2.1673	2.7607	1.1206	2.7607	2.6196		2.6196	3.7793	3.0969	1.8018	1.8018	3.0969	3.7793	2.9668
H7	2.1673	2.7607	2.7607	1.1206	2.6196	2.6196		3.0969	3.7793	3.7793	3.0969	1.8018	1.8018	2.9668
H8	2.1148	1.1050	3.3851	2.6657	1.8018	3.7793	3.0969		1.7914	3.6622	4.2131	3.6622	2.4217	2.3571
H9	2.1148	1.1050	2.6657	3.3851	1.8018	3.0969	3.7793	1.7914		2.4217	3.6622	4.2131	3.6622	2.3571
H10	2.1148	2.6657	1.1050	3.3851	3.0969	1.8018	3.7793	3.6622	2.4217		1.7914	3.6622	4.2131	2.3571
H11	2.1148	3.3851	1.1050	2.6657	3.7793	1.8018	3.0969	4.2131	3.6622	1.7914		2.4217	3.6622	2.3571
H12	2.1148	3.3851	2.6657	1.1050	3.7793	3.0969	1.8018	3.6622	4.2131	3.6622	2.4217		1.7914	2.3571
H13	2.1148	2.6657	3.3851	1.1050	3.0969	3.7793	1.8018	2.4217	3.6622	4.2131	3.6622	1.7914		2.3571
X14	1.0000	2.0084	2.0084	2.0084	2.9668	2.9668	2.9668	2.3571	2.3571	2.3571	2.3571	2.3571	2.3571

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H5	112.910	N1	C2	H8	109.646
N1	C2	H9	109.646	N1	C3	H6	112.910
N1	C3	H10	109.646	N1	C3	H11	109.646
N1	C4	H7	112.910	N1	C4	H12	109.646
N1	C4	H13	109.646	C2	N1	C3	111.549
C2	N1	C4	111.549	C2	N1	X14	107.304
C3	N1	C4	111.549	C3	N1	X14	107.304
C4	N1	X14	107.304	H5	C2	H8	108.109
H5	C2	H9	108.109	H6	C3	H10	108.109
H6	C3	H11	108.109	H7	C4	H12	108.109
H7	C4	H13	108.109	H8	C2	H9	108.303
H10	C3	H11	108.303	H12	C4	H13	108.303

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

using model chemistry: BLYP/aug-cc-pVDZ

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	-0.442
2	C	1.158
3	C	1.158
4	C	1.158
5	H	-0.224
6	H	-0.224
7	H	-0.224
8	H	-0.393
9	H	-0.393
10	H	-0.393
11	H	-0.393
12	H	-0.393
13	H	-0.393

<r²>	92.783
(<r²>)^1/2	9.632

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

using model chemistry: BLYP/aug-cc-pVDZ

States and conformations

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