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	hartrees
Energy at 0K	-173.460602
Energy at 298.15K	-173.471200
Nuclear repulsion energy	137.294849

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3080	2955	48.16
2	A₁	2942	2822	167.12
3	A₁	1563	1500	32.39
4	A₁	1514	1452	0.13
5	A₁	1213	1164	4.79
6	A₁	804	771	18.17
7	A₁	325	312	14.21
8	A₂	3121	2995	0.00
9	A₂	1554	1490	0.00
10	A₂	1077	1033	0.00
11	A₂	283	272	0.00
12	E	3127	3000	39.23
12	E	3127	3000	39.23
13	E	3076	2951	26.45
13	E	3076	2951	26.45
14	E	2927	2808	44.00
14	E	2927	2808	44.01
15	E	1574	1511	7.52
15	E	1574	1511	7.52
16	E	1540	1478	15.60
16	E	1540	1478	15.60
17	E	1475	1415	0.36
17	E	1475	1415	0.36
18	E	1303	1250	4.05
18	E	1303	1250	4.05
19	E	1139	1093	11.27
19	E	1139	1093	11.27
20	E	1056	1013	24.73
20	E	1056	1013	24.73
21	E	418	401	0.19
21	E	418	401	0.19
22	E	272	261	0.96
22	E	272	261	0.96

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.372
C2	0.000	1.404	-0.063
C3	1.216	-0.702	-0.063
C4	-1.216	-0.702	-0.063
H5	0.000	1.521	-1.166
H6	1.317	-0.760	-1.166
H7	-1.317	-0.760	-1.166
H8	-0.889	1.905	0.337
H9	0.889	1.905	0.337
H10	2.095	-0.183	0.337
H11	1.205	-1.723	0.337
H12	-1.205	-1.723	0.337
H13	-2.095	-0.183	0.337
X14	0.000	0.000	1.372

	N1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13	X14
N1		1.4699	1.4699	1.4699	2.1623	2.1623	2.1623	2.1028	2.1028	2.1028	2.1028	2.1028	2.1028	1.0000
C2	1.4699		2.4322	2.4322	1.1090	2.7632	2.7632	1.0960	1.0960	2.6580	3.3749	3.3749	2.6580	2.0074
C3	1.4699	2.4322		2.4322	2.7632	1.1090	2.7632	3.3749	2.6580	1.0960	1.0960	2.6580	3.3749	2.0074
C4	1.4699	2.4322	2.4322		2.7632	2.7632	1.1090	2.6580	3.3749	3.3749	2.6580	1.0960	1.0960	2.0074
H5	2.1623	1.1090	2.7632	2.7632		2.6336	2.6336	1.7876	1.7876	3.0895	3.7720	3.7720	3.0895	2.9581
H6	2.1623	2.7632	1.1090	2.7632	2.6336		2.6336	3.7720	3.0895	1.7876	1.7876	3.0895	3.7720	2.9581
H7	2.1623	2.7632	2.7632	1.1090	2.6336	2.6336		3.0895	3.7720	3.7720	3.0895	1.7876	1.7876	2.9581
H8	2.1028	1.0960	3.3749	2.6580	1.7876	3.7720	3.0895		1.7782	3.6417	4.1892	3.6417	2.4109	2.3435
H9	2.1028	1.0960	2.6580	3.3749	1.7876	3.0895	3.7720	1.7782		2.4109	3.6417	4.1892	3.6417	2.3435
H10	2.1028	2.6580	1.0960	3.3749	3.0895	1.7876	3.7720	3.6417	2.4109		1.7782	3.6417	4.1892	2.3435
H11	2.1028	3.3749	1.0960	2.6580	3.7720	1.7876	3.0895	4.1892	3.6417	1.7782		2.4109	3.6417	2.3435
H12	2.1028	3.3749	2.6580	1.0960	3.7720	3.0895	1.7876	3.6417	4.1892	3.6417	2.4109		1.7782	2.3435
H13	2.1028	2.6580	3.3749	1.0960	3.0895	3.7720	1.7876	2.4109	3.6417	4.1892	3.6417	1.7782		2.3435
X14	1.0000	2.0074	2.0074	2.0074	2.9581	2.9581	2.9581	2.3435	2.3435	2.3435	2.3435	2.3435	2.3435

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H5	113.211	N1	C2	H8	109.209
N1	C2	H9	109.209	N1	C3	H6	113.211
N1	C3	H10	109.209	N1	C3	H11	109.209
N1	C4	H7	113.211	N1	C4	H12	109.209
N1	C4	H13	109.209	C2	N1	C3	111.651
C2	N1	C4	111.651	C2	N1	X14	107.192
C3	N1	C4	111.651	C3	N1	X14	107.192
C4	N1	X14	107.192	H5	C2	H8	108.333
H5	C2	H9	108.333	H6	C3	H10	108.333
H6	C3	H11	108.334	H7	C4	H12	108.334
H7	C4	H13	108.333	H8	C2	H9	108.438
H10	C3	H11	108.438	H12	C4	H13	108.438

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

using model chemistry: B3PW91/3-21G*

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	-0.504
2	C	-0.440
3	C	-0.440
4	C	-0.440
5	H	0.176
6	H	0.176
7	H	0.176
8	H	0.216
9	H	0.216
10	H	0.216
11	H	0.216
12	H	0.216
13	H	0.216

<r²>	91.511
(<r²>)^1/2	9.566

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

using model chemistry: B3PW91/3-21G*

States and conformations

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