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	hartrees
Energy at 0K	-172.337159
Energy at 298.15K	-172.347415
Nuclear repulsion energy	135.082855

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3413	3046	22.75
2	A₁	3251	2901	19.81
3	A₁	1669	1489	11.01
4	A₁	1603	1430	0.17
5	A₁	1252	1117	1.45
6	A₁	827	738	6.71
7	A₁	374	334	8.57
8	A₂	3466	3093	0.00
9	A₂	1675	1495	0.00
10	A₂	1107	988	0.00
11	A₂	251	224	0.00
12	E	3469	3096	1.97
12	E	3469	3096	1.97
13	E	3413	3046	0.03
13	E	3413	3046	0.03
14	E	3250	2900	13.90
14	E	3250	2900	13.90
15	E	1680	1500	2.36
15	E	1680	1500	2.36
16	E	1660	1481	7.03
16	E	1660	1481	7.03
17	E	1565	1396	4.89
17	E	1565	1396	4.89
18	E	1360	1214	0.21
18	E	1360	1214	0.21
19	E	1152	1028	5.47
19	E	1152	1028	5.47
20	E	1091	973	7.75
20	E	1091	973	7.75
21	E	416	371	0.17
21	E	416	371	0.17
22	E	266	237	0.21
22	E	266	237	0.21

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.451
C2	0.000	1.420	-0.078
C3	1.230	-0.710	-0.078
C4	-1.230	-0.710	-0.078
H5	0.000	1.480	-1.187
H6	1.282	-0.740	-1.187
H7	-1.282	-0.740	-1.187
H8	-0.897	1.939	0.301
H9	0.897	1.939	0.301
H10	2.128	-0.193	0.301
H11	1.231	-1.746	0.301
H12	-1.231	-1.746	0.301
H13	-2.128	-0.193	0.301
X14	0.000	0.000	1.451

	N1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13	X14
N1		1.5152	1.5152	1.5152	2.2075	2.2075	2.2075	2.1416	2.1416	2.1416	2.1416	2.1416	2.1416	1.0000
C2	1.5152		2.4597	2.4597	1.1110	2.7459	2.7459	1.1035	1.1035	2.6966	3.4183	3.4183	2.6966	2.0864
C3	1.5152	2.4597		2.4597	2.7459	1.1110	2.7459	3.4183	2.6966	1.1035	1.1035	2.6966	3.4183	2.0864
C4	1.5152	2.4597	2.4597		2.7459	2.7459	1.1110	2.6966	3.4183	3.4183	2.6966	1.1035	1.1035	2.0864
H5	2.2075	1.1110	2.7459	2.7459		2.5636	2.5636	1.7975	1.7975	3.0888	3.7603	3.7603	3.0888	3.0247
H6	2.2075	2.7459	1.1110	2.7459	2.5636		2.5636	3.7603	3.0888	1.7975	1.7975	3.0888	3.7603	3.0247
H7	2.2075	2.7459	2.7459	1.1110	2.5636	2.5636		3.0888	3.7603	3.7603	3.0888	1.7975	1.7975	3.0247
H8	2.1416	1.1035	3.4183	2.6966	1.7975	3.7603	3.0888		1.7941	3.7003	4.2554	3.7003	2.4612	2.4259
H9	2.1416	1.1035	2.6966	3.4183	1.7975	3.0888	3.7603	1.7941		2.4612	3.7003	4.2554	3.7003	2.4259
H10	2.1416	2.6966	1.1035	3.4183	3.0888	1.7975	3.7603	3.7003	2.4612		1.7941	3.7003	4.2554	2.4259
H11	2.1416	3.4183	1.1035	2.6966	3.7603	1.7975	3.0888	4.2554	3.7003	1.7941		2.4612	3.7003	2.4259
H12	2.1416	3.4183	2.6966	1.1035	3.7603	3.0888	1.7975	3.7003	4.2554	3.7003	2.4612		1.7941	2.4259
H13	2.1416	2.6966	3.4183	1.1035	3.0888	3.7603	1.7975	2.4612	3.7003	4.2554	3.7003	1.7941		2.4259
X14	1.0000	2.0864	2.0864	2.0864	3.0247	3.0247	3.0247	2.4259	2.4259	2.4259	2.4259	2.4259	2.4259

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H5	113.507	N1	C2	H8	108.711
N1	C2	H9	108.711	N1	C3	H6	113.507
N1	C3	H10	108.711	N1	C3	H11	108.711
N1	C4	H7	113.507	N1	C4	H12	108.711
N1	C4	H13	108.711	C2	N1	C3	108.514
C2	N1	C4	108.514	C2	N1	X14	110.412
C3	N1	C4	108.514	C3	N1	X14	110.412
C4	N1	X14	110.412	H5	C2	H8	108.526
H5	C2	H9	108.526	H6	C3	H10	108.526
H6	C3	H11	108.526	H7	C4	H12	108.526
H7	C4	H13	108.526	H8	C2	H9	108.769
H10	C3	H11	108.769	H12	C4	H13	108.769

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

using model chemistry: B3LYP/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	-0.226
2	C	-0.146
3	C	-0.146
4	C	-0.146
5	H	0.063
6	H	0.063
7	H	0.063
8	H	0.079
9	H	0.079
10	H	0.079
11	H	0.079
12	H	0.079
13	H	0.079

<r²>	92.333
(<r²>)^1/2	9.609

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

using model chemistry: B3LYP/STO-3G

States and conformations

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