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	hartrees
Energy at 0K	-174.445536
Energy at 298.15K	-174.456159
Nuclear repulsion energy	138.811466

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3070	2955	52.38
2	A₁	2925	2816	220.70
3	A₁	1516	1459	31.71
4	A₁	1494	1438	0.20
5	A₁	1212	1167	18.91
6	A₁	854	822	24.77
7	A₁	355	342	8.95
8	A₂	3109	2993	0.00
9	A₂	1499	1443	0.00
10	A₂	1076	1036	0.00
11	A₂	254	245	0.00
12	E	3114	2998	53.13
12	E	3114	2998	53.13
13	E	3065	2951	37.57
13	E	3065	2951	37.58
14	E	2909	2800	55.32
14	E	2909	2800	55.32
15	E	1525	1468	11.92
15	E	1525	1468	11.92
16	E	1493	1437	10.66
16	E	1493	1437	10.66
17	E	1451	1397	0.15
17	E	1451	1397	0.15
18	E	1320	1271	12.67
18	E	1320	1271	12.67
19	E	1128	1086	8.78
19	E	1128	1086	8.78
20	E	1075	1035	20.97
20	E	1075	1035	20.97
21	E	423	407	0.01
21	E	423	407	0.01
22	E	273	263	0.86
22	E	273	263	0.86

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.373
C2	0.000	1.381	-0.061
C3	1.196	-0.691	-0.061
C4	-1.196	-0.691	-0.061
H5	0.000	1.493	-1.163
H6	1.293	-0.746	-1.163
H7	-1.293	-0.746	-1.163
H8	-0.884	1.895	0.329
H9	0.884	1.895	0.329
H10	2.083	-0.182	0.329
H11	1.199	-1.713	0.329
H12	-1.199	-1.713	0.329
H13	-2.083	-0.182	0.329
X14	0.000	0.000	1.373

	N1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13	X14
N1		1.4478	1.4478	1.4478	2.1415	2.1415	2.1415	2.0910	2.0910	2.0910	2.0910	2.0910	2.0910	1.0000
C2	1.4478		2.3928	2.3928	1.1078	2.7228	2.7228	1.0936	1.0936	2.6333	3.3410	3.3410	2.6333	1.9907
C3	1.4478	2.3928		2.3928	2.7228	1.1078	2.7228	3.3410	2.6333	1.0936	1.0936	2.6333	3.3410	1.9907
C4	1.4478	2.3928	2.3928		2.7228	2.7228	1.1078	2.6333	3.3410	3.3410	2.6333	1.0936	1.0936	1.9907
H5	2.1415	1.1078	2.7228	2.7228		2.5855	2.5855	1.7799	1.7799	3.0608	3.7332	3.7332	3.0608	2.9423
H6	2.1415	2.7228	1.1078	2.7228	2.5855		2.5855	3.7332	3.0608	1.7799	1.7799	3.0608	3.7332	2.9423
H7	2.1415	2.7228	2.7228	1.1078	2.5855	2.5855		3.0608	3.7332	3.7332	3.0608	1.7799	1.7799	2.9423
H8	2.0910	1.0936	3.3410	2.6333	1.7799	3.7332	3.0608		1.7671	3.6209	4.1652	3.6209	2.3981	2.3366
H9	2.0910	1.0936	2.6333	3.3410	1.7799	3.0608	3.7332	1.7671		2.3981	3.6209	4.1652	3.6209	2.3366
H10	2.0910	2.6333	1.0936	3.3410	3.0608	1.7799	3.7332	3.6209	2.3981		1.7671	3.6209	4.1652	2.3366
H11	2.0910	3.3410	1.0936	2.6333	3.7332	1.7799	3.0608	4.1652	3.6209	1.7671		2.3981	3.6209	2.3366
H12	2.0910	3.3410	2.6333	1.0936	3.7332	3.0608	1.7799	3.6209	4.1652	3.6209	2.3981		1.7671	2.3366
H13	2.0910	2.6333	3.3410	1.0936	3.0608	3.7332	1.7799	2.3981	3.6209	4.1652	3.6209	1.7671		2.3366
X14	1.0000	1.9907	1.9907	1.9907	2.9423	2.9423	2.9423	2.3366	2.3366	2.3366	2.3366	2.3366	2.3366

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	H5	113.180	N1	C2	H8	109.944
N1	C2	H9	109.944	N1	C3	H6	113.180
N1	C3	H10	109.944	N1	C3	H11	109.944
N1	C4	H7	113.180	N1	C4	H12	109.944
N1	C4	H13	109.944	C2	N1	C3	111.447
C2	N1	C4	111.447	C2	N1	X14	107.415
C3	N1	C4	111.447	C3	N1	X14	107.415
C4	N1	X14	107.415	H5	C2	H8	107.904
H5	C2	H9	107.904	H6	C3	H10	107.904
H6	C3	H11	107.904	H7	C4	H12	107.904
H7	C4	H13	107.904	H8	C2	H9	107.792
H10	C3	H11	107.792	H12	C4	H13	107.792

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

using model chemistry: B3PW91/6-311G*

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	-0.270
2	C	-0.543
3	C	-0.543
4	C	-0.543
5	H	0.186
6	H	0.186
7	H	0.186
8	H	0.224
9	H	0.224
10	H	0.224
11	H	0.224
12	H	0.224
13	H	0.224

<r²>	90.112
(<r²>)^1/2	9.493

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

using model chemistry: B3PW91/6-311G*

States and conformations

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