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	hartrees
Energy at 0K	-94.518119
Energy at 298.15K	-94.521098
HF Energy	-94.421922
Nuclear repulsion energy	32.819861

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3442	3267	5.22
2	A'	3195	3033	38.60
3	A'	3087	2930	45.70
4	A'	1724	1636	19.58
5	A'	1524	1446	4.64
6	A'	1402	1331	43.66
7	A'	1091	1036	37.72
8	A"	1184	1124	51.82
9	A"	1099	1043	10.97

Atom	x (Å)	y (Å)
C1	0.056	0.587
N2	0.056	-0.686
H3	-0.836	1.226
H4	1.012	1.113
H5	-0.899	-1.054

	C1	N2	H3	H4	H5
C1		1.2730	1.0973	1.0913	1.8981
N2	1.2730		2.1100	2.0373	1.0232
H3	1.0973	2.1100		1.8515	2.2806
H4	1.0913	2.0373	1.8515		2.8889
H5	1.8981	1.0232	2.2806	2.8889

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	111.048		N2	C1	H3	125.632
N2	C1	H4	118.816		H3	C1	H4	115.552

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: B2PLYP/6-31G*

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	-0.126
2	N	-0.474
3	H	0.138
4	H	0.161
5	H	0.300

	x	y	z	Total
	-1.446	1.415	0.000	2.023
CHELPG
AIM
ESP

	x	y	z
x	2.552	0.268	0.000
y	0.268	3.603	0.000
z	0.000	0.000	1.147

<r²>	19.584
(<r²>)^1/2	4.425

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: B2PLYP/6-31G*

States and conformations

All results from a given calculation for CH₂NH (Methanimine)