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	hartrees
Energy at 0K	-94.601463
Energy at 298.15K
HF Energy	-94.601463
Nuclear repulsion energy	33.030027

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3475	3475	1.19
2	A'	3168	3168	36.28
3	A'	3068	3068	41.51
4	A'	1761	1761	26.11
5	A'	1519	1519	6.76
6	A'	1399	1399	39.00
7	A'	1095	1095	35.87
8	A"	1191	1191	55.22
9	A"	1112	1112	17.37

Atom	x (Å)	y (Å)
C1	0.056	0.582
N2	0.056	-0.681
H3	-0.841	1.209
H4	1.013	1.104
H5	-0.901	-1.039

	C1	N2	H3	H4	H5
C1		1.2625	1.0950	1.0905	1.8825
N2	1.2625		2.0922	2.0254	1.0222
H3	1.0950	2.0922		1.8575	2.2493
H4	1.0905	2.0254	1.8575		2.8739
H5	1.8825	1.0222	2.2493	2.8739

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	110.530		N2	C1	H3	124.970
N2	C1	H4	118.627		H3	C1	H4	116.403

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: M06-2X/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	-0.247
2	N	-0.454
3	H	0.194
4	H	0.219
5	H	0.288

	x	y	z	Total
	-1.487	1.452	0.000	2.078
CHELPG
AIM
ESP

	x	y	z
x	2.576	0.236	0.000
y	0.236	3.732	0.000
z	0.000	0.000	1.427

<r²>	19.497
(<r²>)^1/2	4.415

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: M06-2X/6-311G*

States and conformations

All results from a given calculation for CH₂NH (Methanimine)