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	hartrees
Energy at 0K	-95.821409
Energy at 298.15K
HF Energy	-95.679983
Nuclear repulsion energy	42.090031

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'	3527	3527	0.16	111.55	0.09	0.16
2	A'	3092	3092	33.58	97.52	0.27	0.43
3	A'	3004	3004	82.77	150.88	0.12	0.21
4	A'	1673	1673	20.26	5.30	0.69	0.82
5	A'	1513	1513	6.35	12.07	0.64	0.78
6	A'	1472	1472	1.92	2.20	0.54	0.70
7	A'	1183	1183	6.74	1.95	0.45	0.62
8	A'	1068	1068	10.32	9.41	0.24	0.39
9	A'	846	846	154.96	1.68	0.65	0.79
10	A"	3608	3608	1.17	54.76	0.75	0.86
11	A"	3129	3129	29.49	63.31	0.75	0.86
12	A"	1534	1534	3.70	10.76	0.75	0.86
13	A"	1358	1358	0.03	1.33	0.75	0.86
14	A"	982	982	0.02	0.01	0.75	0.86
15	A"	301	301	34.62	0.64	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.050	0.705	0.000
N2	0.050	-0.757	0.000
H3	-0.941	1.169	0.000
H4	0.587	1.062	0.876
H5	0.587	1.062	-0.876
H6	-0.441	-1.110	-0.810
H7	-0.441	-1.110	0.810

	C1	N2	H3	H4	H5	H6	H7
C1		1.4619	1.0946	1.0878	1.0878	2.0471	2.0471
N2	1.4619		2.1664	2.0893	2.0893	1.0103	1.0103
H3	1.0946	2.1664		1.7649	1.7649	2.4704	2.4704
H4	1.0878	2.0893	1.7649		1.7516	2.9354	2.4043
H5	1.0878	2.0893	1.7649	1.7516		2.4043	2.9354
H6	2.0471	1.0103	2.4704	2.9354	2.4043		1.6191
H7	2.0471	1.0103	2.4704	2.4043	2.9354	1.6191

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	110.469	C1	N2	H7	110.469
N2	C1	H3	115.107	N2	C1	H4	109.177
N2	C1	H5	109.177	H3	C1	H4	107.932
H3	C1	H5	107.932	H4	C1	H5	107.232
H6	N2	H7	106.506

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

using model chemistry: B2PLYP=FULL/Def2TZVPP

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/Def2TZVPP

States and conformations

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