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	hartrees
Energy at 0K	-95.853470
Energy at 298.15K
HF Energy	-95.853470
Nuclear repulsion energy	42.047217

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3543	3389	0.60	99.32	0.12	0.21
2	A'	3078	2944	42.30	94.81	0.28	0.44
3	A'	2977	2848	92.83	141.43	0.15	0.26
4	A'	1676	1603	25.47	6.81	0.73	0.85
5	A'	1504	1438	7.72	15.59	0.68	0.81
6	A'	1468	1404	2.08	4.46	0.68	0.81
7	A'	1179	1128	7.13	2.20	0.51	0.67
8	A'	1091	1044	11.04	8.22	0.30	0.46
9	A'	855	818	168.25	2.87	0.66	0.79
10	A"	3623	3466	0.06	60.04	0.75	0.86
11	A"	3117	2982	36.66	72.48	0.75	0.86
12	A"	1524	1458	3.92	15.30	0.75	0.86
13	A"	1357	1298	0.23	2.17	0.75	0.86
14	A"	989	946	0.03	0.20	0.75	0.86
15	A"	317	303	40.46	1.38	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.050	0.702	0.000
N2	0.050	-0.757	0.000
H3	-0.945	1.174	0.000
H4	0.591	1.064	0.878
H5	0.591	1.064	-0.878
H6	-0.445	-1.106	-0.811
H7	-0.445	-1.106	0.811

	C1	N2	H3	H4	H5	H6	H7
C1		1.4593	1.1010	1.0930	1.0930	2.0428	2.0428
N2	1.4593		2.1721	2.0927	2.0927	1.0127	1.0127
H3	1.1010	2.1721		1.7727	1.7727	2.4706	2.4706
H4	1.0930	2.0927	1.7727		1.7562	2.9387	2.4055
H5	1.0930	2.0927	1.7727	1.7562		2.4055	2.9387
H6	2.0428	1.0127	2.4706	2.9387	2.4055		1.6226
H7	2.0428	1.0127	2.4706	2.4055	2.9387	1.6226

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	110.146	C1	N2	H7	110.146
N2	C1	H3	115.361	N2	C1	H4	109.318
N2	C1	H5	109.318	H3	C1	H4	107.800
H3	C1	H5	107.800	H4	C1	H5	106.912
H6	N2	H7	106.475

All results from a given calculation for CH₃NH₂ (methyl amine)

using model chemistry: wB97X-D/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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Number	Element	Mulliken
1	C	-0.223
2	N	-0.494
3	H	0.091
4	H	0.117
5	H	0.117
6	H	0.196
7	H	0.196

	x	y	z	Total
	-1.362	0.346	0.000	1.405
CHELPG
AIM
ESP

	x	y	z
x	2.765	0.124	0.000
y	0.124	3.315	0.000
z	0.000	0.000	3.069

<r²>	26.528
(<r²>)^1/2	5.151

All results from a given calculation for CH3NH2 (methyl amine)

using model chemistry: wB97X-D/6-311G**

States and conformations

All results from a given calculation for CH₃NH₂ (methyl amine)