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	hartrees
Energy at 0K	-94.044337
Energy at 298.15K
HF Energy	-94.044337
Nuclear repulsion energy	32.731310

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3305	3131	6.21
2	A'	3184	3016	28.40
3	A'	3063	2902	29.81
4	A'	1725	1634	9.29
5	A'	1544	1463	3.29
6	A'	1376	1303	56.36
7	A'	1097	1039	53.99
8	A"	1195	1132	57.97
9	A"	1136	1076	23.76

Atom	x (Å)	y (Å)
C1	0.055	0.590
N2	0.055	-0.685
H3	-0.829	1.235
H4	1.011	1.109
H5	-0.899	-1.093

	C1	N2	H3	H4	H5
C1		1.2753	1.0936	1.0875	1.9350
N2	1.2753		2.1133	2.0328	1.0379
H3	1.0936	2.1133		1.8438	2.3287
H4	1.0875	2.0328	1.8438		2.9151
H5	1.9350	1.0379	2.3287	2.9151

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	113.147		N2	C1	H3	126.099
N2	C1	H4	118.488		H3	C1	H4	115.412

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: M06-2X/3-21G*

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	-0.152
2	N	-0.503
3	H	0.176
4	H	0.210
5	H	0.270

	x	y	z	Total
	-1.594	1.328	0.000	2.075
CHELPG
AIM
ESP

	x	y	z
x	2.289	0.346	0.000
y	0.346	3.391	0.000
z	0.000	0.000	0.873

<r²>	19.682
(<r²>)^1/2	4.436

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: M06-2X/3-21G*

States and conformations

All results from a given calculation for CH₂NH (Methanimine)