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	hartrees
Energy at 0K	-173.336174
Energy at 298.15K	-173.346997
HF Energy	-173.336174
Nuclear repulsion energy	139.446096

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3231	2923	68.34
2	A	3231	2923	68.34
3	A	3223	2915	0.00
4	A	3196	2892	46.92
5	A	3187	2883	41.90
6	A	3187	2883	41.90
7	A	3074	2781	214.21
8	A	3059	2767	40.43
9	A	3059	2767	40.43
10	A	1630	1475	10.26
11	A	1630	1475	10.26
12	A	1625	1470	20.76
13	A	1613	1459	0.01
14	A	1610	1456	0.00
15	A	1604	1451	5.16
16	A	1604	1451	5.16
17	A	1566	1417	3.20
18	A	1566	1417	3.20
19	A	1429	1293	19.08
20	A	1429	1293	19.08
21	A	1320	1194	25.62
22	A	1213	1097	8.70
23	A	1213	1097	8.70
24	A	1159	1048	0.00
25	A	1140	1031	25.64
26	A	1140	1031	25.64
27	A	893	808	19.46
28	A	453	410	0.02
29	A	453	410	0.02
30	A	386	349	10.26
31	A	281	254	0.45
32	A	281	254	0.45
33	A	248	224	0.00

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.359
C2	-1.382	-0.000	-0.059
C3	0.691	1.196	-0.059
C4	0.691	-1.196	-0.059
H5	-1.495	-0.000	-1.147
H6	0.748	1.295	-1.147
H7	0.748	-1.295	-1.147
H8	-1.885	-0.876	0.331
H9	-1.885	0.876	0.331
H10	0.184	2.070	0.331
H11	1.701	1.195	0.331
H12	1.701	-1.195	0.331
H13	0.184	-2.070	0.331

	N1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13
N1		1.4432	1.4432	1.4432	2.1221	2.1221	2.1221	2.0788	2.0788	2.0788	2.0788	2.0788	2.0788
C2	1.4432		2.3929	2.3929	1.0944	2.7195	2.7195	1.0826	1.0826	2.6247	3.3288	3.3288	2.6247
C3	1.4432	2.3929		2.3929	2.7195	1.0944	2.7195	3.3288	2.6247	1.0826	1.0826	2.6247	3.3288
C4	1.4432	2.3929	2.3929		2.7195	2.7195	1.0944	2.6247	3.3288	3.3288	2.6247	1.0826	1.0826
H5	2.1221	1.0944	2.7195	2.7195		2.5900	2.5900	1.7614	1.7614	3.0480	3.7185	3.7185	3.0480
H6	2.1221	2.7195	1.0944	2.7195	2.5900		2.5900	3.7185	3.0480	1.7614	1.7614	3.0480	3.7185
H7	2.1221	2.7195	2.7195	1.0944	2.5900	2.5900		3.0480	3.7185	3.7185	3.0480	1.7614	1.7614
H8	2.0788	1.0826	3.3288	2.6247	1.7614	3.7185	3.0480		1.7517	3.6002	4.1408	3.6002	2.3892
H9	2.0788	1.0826	2.6247	3.3288	1.7614	3.0480	3.7185	1.7517		2.3892	3.6002	4.1408	3.6002
H10	2.0788	2.6247	1.0826	3.3288	3.0480	1.7614	3.7185	3.6002	2.3892		1.7517	3.6002	4.1408
H11	2.0788	3.3288	1.0826	2.6247	3.7185	1.7614	3.0480	4.1408	3.6002	1.7517		2.3892	3.6002
H12	2.0788	3.3288	2.6247	1.0826	3.7185	3.0480	1.7614	3.6002	4.1408	3.6002	2.3892		1.7517
H13	2.0788	2.6247	3.3288	1.0826	3.0480	3.7185	1.7614	2.3892	3.6002	4.1408	3.6002	1.7517

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H5	112.773	N1	C2	H8	109.956
N1	C2	H9	109.956	N1	C3	H6	112.773
N1	C3	H10	109.956	N1	C3	H11	109.956
N1	C4	H7	112.773	N1	C4	H12	109.956
N1	C4	H13	109.956	C2	N1	C3	112.001
C2	N1	C4	112.001	C3	N1	C4	112.001
H5	C2	H8	108.008	H5	C2	H9	108.008
H6	C3	H10	108.008	H6	C3	H11	108.008
H7	C4	H12	108.008	H7	C4	H13	108.009
H8	C2	H9	107.998	H10	C3	H11	107.998
H12	C4	H13	107.997

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

using model chemistry: HF/daug-cc-pVTZ

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	0.584
2	C	-1.864
3	C	-1.864
4	C	-1.864
5	H	0.542
6	H	0.542
7	H	0.542
8	H	0.564
9	H	0.564
10	H	0.564
11	H	0.564
12	H	0.564
13	H	0.564

<r²>	89.754
(<r²>)^1/2	9.474

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

using model chemistry: HF/daug-cc-pVTZ

States and conformations

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