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	hartrees
Energy at 0K	-95.386937
Energy at 298.15K
HF Energy	-95.386937
Nuclear repulsion energy	42.115084

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'	3436	3403	0.04	122.51	0.10	0.18
2	A'	2992	2963	26.15	114.21	0.24	0.39
3	A'	2885	2857	93.24	183.21	0.15	0.27
4	A'	1588	1573	22.62	6.65	0.62	0.77
5	A'	1421	1407	8.07	15.25	0.58	0.73
6	A'	1384	1370	1.03	4.87	0.53	0.69
7	A'	1130	1119	6.10	1.37	0.67	0.81
8	A'	1086	1075	10.20	6.25	0.22	0.37
9	A'	781	774	172.96	2.93	0.74	0.85
10	A"	3519	3485	3.29	60.80	0.75	0.86
11	A"	3034	3004	18.79	71.87	0.75	0.86
12	A"	1444	1430	5.33	12.33	0.75	0.86
13	A"	1289	1277	0.41	0.77	0.75	0.86
14	A"	939	930	0.64	0.16	0.75	0.86
15	A"	298	295	36.30	1.10	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.048	0.693	0.000
N2	0.048	-0.749	0.000
H3	-0.946	1.184	0.000
H4	0.596	1.063	0.880
H5	0.596	1.063	-0.880
H6	-0.438	-1.115	-0.819
H7	-0.438	-1.115	0.819

	C1	N2	H3	H4	H5	H6	H7
C1		1.4420	1.1087	1.0999	1.0999	2.0437	2.0437
N2	1.4420		2.1730	2.0866	2.0866	1.0203	1.0203
H3	1.1087	2.1730		1.7793	1.7793	2.4922	2.4922
H4	1.0999	2.0866	1.7793		1.7594	2.9486	2.4110
H5	1.0999	2.0866	1.7793	1.7594		2.4110	2.9486
H6	2.0437	1.0203	2.4922	2.9486	2.4110		1.6377
H7	2.0437	1.0203	2.4922	2.4110	2.9486	1.6377

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	111.037	C1	N2	H7	111.037
N2	C1	H3	116.233	N2	C1	H4	109.613
N2	C1	H5	109.613	H3	C1	H4	107.337
H3	C1	H5	107.337	H4	C1	H5	106.225
H6	N2	H7	106.749

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

using model chemistry: SVWN/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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Number	Element	Mulliken
1	C	-0.248
2	N	-0.336
3	H	0.072
4	H	0.110
5	H	0.110
6	H	0.145
7	H	0.145

	x	y	z	Total
	-1.218	0.203	0.000	1.235
CHELPG
AIM
ESP

	x	y	z
x	3.238	0.078	0.000
y	0.078	3.873	0.000
z	0.000	0.000	3.431

<r²>	26.616
(<r²>)^1/2	5.159

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

using model chemistry: SVWN/cc-pVTZ

States and conformations

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