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	hartrees
Energy at 0K	-172.207160
Energy at 298.15K	-172.217267
Nuclear repulsion energy	133.634777

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3302	3055	28.19
2	A₁	3140	2906	26.14
3	A₁	1623	1502	8.94
4	A₁	1550	1434	0.30
5	A₁	1204	1114	0.30
6	A₁	763	706	5.27
7	A₁	371	343	7.25
8	A₂	3358	3107	0.00
9	A₂	1629	1507	0.00
10	A₂	1068	989	0.00
11	A₂	247	229	0.00
12	E	3361	3110	3.75
12	E	3361	3110	3.75
13	E	3301	3054	0.22
13	E	3301	3054	0.22
14	E	3139	2904	17.10
14	E	3139	2904	17.10
15	E	1633	1511	1.89
15	E	1633	1511	1.89
16	E	1614	1493	7.02
16	E	1614	1493	7.02
17	E	1511	1398	6.21
17	E	1511	1398	6.21
18	E	1295	1198	0.97
18	E	1295	1198	0.97
19	E	1105	1023	4.66
19	E	1105	1023	4.66
20	E	1027	950	6.94
20	E	1027	950	6.94
21	E	401	371	0.17
21	E	401	371	0.17
22	E	261	242	0.17
22	E	261	242	0.17

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.478
C2	0.000	1.433	-0.084
C3	1.241	-0.716	-0.084
C4	-1.241	-0.716	-0.084
H5	0.000	1.481	-1.202
H6	1.282	-0.740	-1.202
H7	-1.282	-0.740	-1.202
H8	-0.904	1.957	0.294
H9	0.904	1.957	0.294
H10	2.147	-0.196	0.294
H11	1.243	-1.762	0.294
H12	-1.243	-1.762	0.294
H13	-2.147	-0.196	0.294
X14	0.000	0.000	1.478

	N1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13	X14
N1		1.5389	1.5389	1.5389	2.2391	2.2391	2.2391	2.1640	2.1640	2.1640	2.1640	2.1640	2.1640	1.0000
C2	1.5389		2.4818	2.4818	1.1195	2.7600	2.7600	1.1113	1.1113	2.7214	3.4487	3.4487	2.7214	2.1192
C3	1.5389	2.4818		2.4818	2.7600	1.1195	2.7600	3.4487	2.7214	1.1113	1.1113	2.7214	3.4487	2.1192
C4	1.5389	2.4818	2.4818		2.7600	2.7600	1.1195	2.7214	3.4487	3.4487	2.7214	1.1113	1.1113	2.1192
H5	2.2391	1.1195	2.7600	2.7600		2.5644	2.5644	1.8119	1.8119	3.1079	3.7810	3.7810	3.1079	3.0616
H6	2.2391	2.7600	1.1195	2.7600	2.5644		2.5644	3.7810	3.1079	1.8119	1.8119	3.1079	3.7810	3.0616
H7	2.2391	2.7600	2.7600	1.1195	2.5644	2.5644		3.1079	3.7810	3.7810	3.1079	1.8119	1.8119	3.0616
H8	2.1640	1.1113	3.4487	2.7214	1.8119	3.7810	3.1079		1.8081	3.7346	4.2945	3.7346	2.4864	2.4597
H9	2.1640	1.1113	2.7214	3.4487	1.8119	3.1079	3.7810	1.8081		2.4864	3.7346	4.2945	3.7346	2.4597
H10	2.1640	2.7214	1.1113	3.4487	3.1079	1.8119	3.7810	3.7346	2.4864		1.8081	3.7346	4.2945	2.4597
H11	2.1640	3.4487	1.1113	2.7214	3.7810	1.8119	3.1079	4.2945	3.7346	1.8081		2.4864	3.7346	2.4597
H12	2.1640	3.4487	2.7214	1.1113	3.7810	3.1079	1.8119	3.7346	4.2945	3.7346	2.4864		1.8081	2.4597
H13	2.1640	2.7214	3.4487	1.1113	3.1079	3.7810	1.8119	2.4864	3.7346	4.2945	3.7346	1.8081		2.4597
X14	1.0000	2.1192	2.1192	2.1192	3.0616	3.0616	3.0616	2.4597	2.4597	2.4597	2.4597	2.4597	2.4597

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H5	113.831	N1	C2	H8	108.396
N1	C2	H9	108.396	N1	C3	H6	113.831
N1	C3	H10	108.397	N1	C3	H11	108.397
N1	C4	H7	113.831	N1	C4	H12	108.397
N1	C4	H13	108.397	C2	N1	C3	107.485
C2	N1	C4	107.485	C2	N1	X14	111.391
C3	N1	C4	107.485	C3	N1	X14	111.391
C4	N1	X14	111.391	H5	C2	H8	108.623
H5	C2	H9	108.623	H6	C3	H10	108.623
H6	C3	H11	108.623	H7	C4	H12	108.623
H7	C4	H13	108.623	H8	C2	H9	108.876
H10	C3	H11	108.876	H12	C4	H13	108.876

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

using model chemistry: BLYP/STO-3G

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	-0.211
2	C	-0.145
3	C	-0.145
4	C	-0.145
5	H	0.062
6	H	0.062
7	H	0.062
8	H	0.077
9	H	0.077
10	H	0.077
11	H	0.077
12	H	0.077
13	H	0.077

<r²>	93.781
(<r²>)^1/2	9.684

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

using model chemistry: BLYP/STO-3G

States and conformations

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