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	hartrees
Energy at 0K	-173.290949
Energy at 298.15K	-173.301790
Nuclear repulsion energy	138.975208

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3212	2925	56.44
2	A₁	3089	2813	205.64
3	A₁	1607	1463	21.58
4	A₁	1594	1452	0.34
5	A₁	1307	1190	24.77
6	A₁	898	818	19.17
7	A₁	394	358	10.09
8	A₂	3242	2952	0.00
9	A₂	1588	1446	0.00
10	A₂	1145	1043	0.00
11	A₂	238	217	0.00
12	E	3251	2960	68.85
12	E	3251	2960	68.85
13	E	3203	2917	41.01
13	E	3203	2917	41.01
14	E	3073	2798	44.13
14	E	3073	2798	44.13
15	E	1610	1466	11.47
15	E	1610	1466	11.47
16	E	1584	1442	4.56
16	E	1584	1442	4.56
17	E	1546	1407	3.39
17	E	1546	1407	3.39
18	E	1423	1296	18.30
18	E	1423	1296	18.30
19	E	1199	1092	9.83
19	E	1199	1092	9.83
20	E	1138	1036	21.34
20	E	1138	1036	21.34
21	E	455	415	0.02
21	E	455	415	0.02
22	E	283	257	0.45
22	E	283	257	0.45

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.366
C2	0.000	1.384	-0.060
C3	1.198	-0.692	-0.060
C4	-1.198	-0.692	-0.060
H5	0.000	1.493	-1.155
H6	1.293	-0.746	-1.155
H7	-1.293	-0.746	-1.155
H8	-0.881	1.891	0.330
H9	0.881	1.891	0.330
H10	2.079	-0.182	0.330
H11	1.197	-1.709	0.330
H12	-1.197	-1.709	0.330
H13	-2.079	-0.182	0.330
X14	0.000	0.000	1.366

	N1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13	X14
N1		1.4476	1.4476	1.4476	2.1313	2.1313	2.1313	2.0869	2.0869	2.0869	2.0869	2.0869	2.0869	1.0000
C2	1.4476		2.3964	2.3964	1.1011	2.7217	2.7217	1.0894	1.0894	2.6315	3.3390	3.3390	2.6315	1.9867
C3	1.4476	2.3964		2.3964	2.7217	1.1011	2.7217	3.3390	2.6315	1.0894	1.0894	2.6315	3.3390	1.9867
C4	1.4476	2.3964	2.3964		2.7217	2.7217	1.1011	2.6315	3.3390	3.3390	2.6315	1.0894	1.0894	1.9867
H5	2.1313	1.1011	2.7217	2.7217		2.5852	2.5852	1.7730	1.7730	3.0551	3.7270	3.7270	3.0551	2.9301
H6	2.1313	2.7217	1.1011	2.7217	2.5852		2.5852	3.7270	3.0551	1.7730	1.7730	3.0551	3.7270	2.9301
H7	2.1313	2.7217	2.7217	1.1011	2.5852	2.5852		3.0551	3.7270	3.7270	3.0551	1.7730	1.7730	2.9301
H8	2.0869	1.0894	3.3390	2.6315	1.7730	3.7270	3.0551		1.7627	3.6141	4.1572	3.6141	2.3945	2.3294
H9	2.0869	1.0894	2.6315	3.3390	1.7730	3.0551	3.7270	1.7627		2.3945	3.6141	4.1572	3.6141	2.3294
H10	2.0869	2.6315	1.0894	3.3390	3.0551	1.7730	3.7270	3.6141	2.3945		1.7627	3.6141	4.1572	2.3294
H11	2.0869	3.3390	1.0894	2.6315	3.7270	1.7730	3.0551	4.1572	3.6141	1.7627		2.3945	3.6141	2.3294
H12	2.0869	3.3390	2.6315	1.0894	3.7270	3.0551	1.7730	3.6141	4.1572	3.6141	2.3945		1.7627	2.3294
H13	2.0869	2.6315	3.3390	1.0894	3.0551	3.7270	1.7730	2.3945	3.6141	4.1572	3.6141	1.7627		2.3294
X14	1.0000	1.9867	1.9867	1.9867	2.9301	2.9301	2.9301	2.3294	2.3294	2.3294	2.3294	2.3294	2.3294

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H5	112.787	N1	C2	H8	109.884
N1	C2	H9	109.884	N1	C3	H6	112.787
N1	C3	H10	109.884	N1	C3	H11	109.884
N1	C4	H7	112.787	N1	C4	H12	109.884
N1	C4	H13	109.884	C2	N1	C3	111.731
C2	N1	C4	111.731	C2	N1	X14	107.104
C3	N1	C4	111.731	C3	N1	X14	107.104
C4	N1	X14	107.104	H5	C2	H8	108.073
H5	C2	H9	108.073	H6	C3	H10	108.073
H6	C3	H11	108.073	H7	C4	H12	108.073
H7	C4	H13	108.073	H8	C2	H9	108.001
H10	C3	H11	108.001	H12	C4	H13	108.001

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

using model chemistry: HF/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	-1.043
2	C	0.708
3	C	0.708
4	C	0.708
5	H	-0.019
6	H	-0.019
7	H	-0.019
8	H	-0.171
9	H	-0.171
10	H	-0.171
11	H	-0.171
12	H	-0.171
13	H	-0.171

<r²>	90.206
(<r²>)^1/2	9.498

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

using model chemistry: HF/aug-cc-pVDZ

States and conformations

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