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	hartrees
Energy at 0K	-95.815380
Energy at 298.15K
HF Energy	-95.675738
Nuclear repulsion energy	42.100524

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'	3523	3367	0.37	109.97	0.10	0.18
2	A'	3090	2954	35.42	98.24	0.25	0.40
3	A'	3003	2870	85.18	145.55	0.13	0.23
4	A'	1674	1600	19.78	5.10	0.67	0.81
5	A'	1517	1450	6.16	10.93	0.66	0.80
6	A'	1471	1406	1.82	2.60	0.50	0.67
7	A'	1186	1134	7.59	1.91	0.39	0.56
8	A'	1069	1021	9.17	8.88	0.25	0.40
9	A'	857	819	151.44	2.09	0.56	0.72
10	A"	3603	3444	0.50	56.34	0.75	0.86
11	A"	3124	2986	30.60	64.88	0.75	0.86
12	A"	1537	1469	3.35	10.22	0.75	0.86
13	A"	1361	1301	0.07	1.25	0.75	0.86
14	A"	982	939	0.02	0.06	0.75	0.86
15	A"	307	294	33.82	0.84	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.050	0.704	0.000
N2	0.050	-0.758	0.000
H3	-0.939	1.171	0.000
H4	0.588	1.062	0.875
H5	0.588	1.062	-0.875
H6	-0.446	-1.106	-0.808
H7	-0.446	-1.106	0.808

	C1	N2	H3	H4	H5	H6	H7
C1		1.4616	1.0945	1.0876	1.0876	2.0430	2.0430
N2	1.4616		2.1677	2.0894	2.0894	1.0105	1.0105
H3	1.0945	2.1677		1.7640	1.7640	2.4653	2.4653
H4	1.0876	2.0894	1.7640		1.7496	2.9328	2.4027
H5	1.0876	2.0894	1.7640	1.7496		2.4027	2.9328
H6	2.0430	1.0105	2.4653	2.9328	2.4027		1.6166
H7	2.0430	1.0105	2.4653	2.4027	2.9328	1.6166

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	110.129	C1	N2	H7	110.129
N2	C1	H3	115.256	N2	C1	H4	109.222
N2	C1	H5	109.222	H3	C1	H4	107.872
H3	C1	H5	107.872	H4	C1	H5	107.090
H6	N2	H7	106.232

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

using model chemistry: B2PLYP=FULL/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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All results from a given calculation for CH3NH2 (methyl amine)

using model chemistry: B2PLYP=FULL/cc-pVTZ

States and conformations

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