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	hartrees
Energy at 0K	-95.242514
Energy at 298.15K
HF Energy	-95.242514
Nuclear repulsion energy	42.322100

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'	3725	3384	0.26	96.24	0.12	0.22
2	A'	3198	2906	59.26	97.62	0.27	0.43
3	A'	3115	2830	100.46	130.18	0.16	0.27
4	A'	1802	1637	27.62	5.28	0.75	0.86
5	A'	1617	1469	6.40	13.14	0.72	0.84
6	A'	1583	1438	3.37	2.76	0.73	0.84
7	A'	1271	1155	15.77	1.90	0.46	0.63
8	A'	1139	1035	20.40	11.66	0.31	0.47
9	A'	927	842	165.46	2.60	0.62	0.76
10	A"	3800	3452	0.32	62.30	0.75	0.86
11	A"	3231	2936	54.88	77.00	0.75	0.86
12	A"	1636	1486	2.65	13.87	0.75	0.86
13	A"	1462	1328	0.00	2.25	0.75	0.86
14	A"	1045	950	0.06	0.16	0.75	0.86
15	A"	334	304	40.41	1.30	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.049	0.701	0.000
N2	0.049	-0.753	0.000
H3	-0.943	1.156	0.000
H4	0.582	1.061	0.874
H5	0.582	1.061	-0.874
H6	-0.430	-1.106	-0.804
H7	-0.430	-1.106	0.804

	C1	N2	H3	H4	H5	H6	H7
C1		1.4542	1.0916	1.0849	1.0849	2.0350	2.0350
N2	1.4542		2.1517	2.0828	2.0828	1.0000	1.0000
H3	1.0916	2.1517		1.7604	1.7604	2.4549	2.4549
H4	1.0849	2.0828	1.7604		1.7474	2.9212	2.3927
H5	1.0849	2.0828	1.7604	1.7474		2.3927	2.9212
H6	2.0350	1.0000	2.4549	2.9212	2.3927		1.6071
H7	2.0350	1.0000	2.4549	2.3927	2.9212	1.6071

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	110.668	C1	N2	H7	110.668
N2	C1	H3	114.641	N2	C1	H4	109.362
N2	C1	H5	109.362	H3	C1	H4	107.966
H3	C1	H5	107.966	H4	C1	H5	107.286
H6	N2	H7	106.940

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

using model chemistry: HF/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	-0.095
2	N	-0.509
3	H	0.064
4	H	0.087
5	H	0.087
6	H	0.183
7	H	0.183

	x	y	z	Total
	-1.374	0.381	0.000	1.426
CHELPG
AIM
ESP

	x	y	z
x	2.625	0.128	0.000
y	0.128	3.128	0.000
z	0.000	0.000	2.931

<r²>	26.360
(<r²>)^1/2	5.134

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

using model chemistry: HF/6-311G**

States and conformations

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