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	hartrees
Energy at 0K	-18.511650
Energy at 298.15K	-18.517286
Nuclear repulsion energy	26.343031

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3540	3388	0.55
2	A'	3106	2973	52.75
3	A'	3003	2875	111.16
4	A'	1680	1608	29.20
5	A'	1491	1427	7.97
6	A'	1449	1387	2.31
7	A'	1163	1114	5.78
8	A'	1090	1043	16.39
9	A'	860	823	179.34
10	A"	3637	3481	0.09
11	A"	3146	3011	47.41
12	A"	1509	1444	3.84
13	A"	1335	1278	0.41
14	A"	963	922	0.03
15	A"	324	310	51.23

Atom	x (Å)	y (Å)	z (Å)
C1	0.051	0.706	0.000
N2	0.051	-0.764	0.000
H3	-0.951	1.186	0.000
H4	0.599	1.069	0.886
H5	0.599	1.069	-0.886
H6	-0.457	-1.106	-0.816
H7	-0.457	-1.106	0.816

	C1	N2	H3	H4	H5	H6	H7
C1		1.4705	1.1113	1.1031	1.1031	2.0512	2.0512
N2	1.4705		2.1927	2.1084	2.1084	1.0203	1.0203
H3	1.1113	2.1927		1.7892	1.7892	2.4823	2.4823
H4	1.1031	2.1084	1.7892		1.7730	2.9565	2.4179
H5	1.1031	2.1084	1.7892	1.7730		2.4179	2.9565
H6	2.0512	1.0203	2.4823	2.9565	2.4179		1.6329
H7	2.0512	1.0203	2.4823	2.4179	2.9565	1.6329

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	109.547	C1	N2	H7	109.547
N2	C1	H3	115.564	N2	C1	H4	109.188
N2	C1	H5	109.188	H3	C1	H4	107.799
H3	C1	H5	107.799	H4	C1	H5	106.964
H6	N2	H7	106.296

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

using model chemistry: B1B95/CEP-31G*

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	-0.500
2	N	-0.500
3	H	0.142
4	H	0.170
5	H	0.170
6	H	0.259
7	H	0.259

	x	y	z	Total
	-1.576	0.418	0.000	1.630
CHELPG
AIM
ESP

	x	y	z
x	2.353	0.082	0.000
y	0.082	3.020	0.000
z	0.000	0.000	2.786

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: B1B95/CEP-31G*

States and conformations

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