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	hartrees
Energy at 0K	-94.576042
Energy at 298.15K	-94.579023
HF Energy	-94.576042
Nuclear repulsion energy	32.954056

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3445	3262	1.67
2	A'	3190	3021	37.06
3	A'	3096	2932	35.97
4	A'	1773	1679	27.95
5	A'	1523	1442	4.44
6	A'	1389	1316	41.03
7	A'	1084	1027	37.18
8	A"	1185	1122	51.51
9	A"	1113	1054	15.09

Atom	x (Å)	y (Å)
C1	0.056	0.583
N2	0.056	-0.683
H3	-0.839	1.215
H4	1.014	1.107
H5	-0.906	-1.037

	C1	N2	H3	H4	H5
C1		1.2659	1.0963	1.0919	1.8837
N2	1.2659		2.0989	2.0304	1.0247
H3	1.0963	2.0989		1.8563	2.2531
H4	1.0919	2.0304	1.8563		2.8777
H5	1.8837	1.0247	2.2531	2.8777

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	110.198		N2	C1	H3	125.227
N2	C1	H4	118.701		H3	C1	H4	116.072

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: M06-2X/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	-0.134
2	N	-0.491
3	H	0.147
4	H	0.169
5	H	0.309

	x	y	z	Total
	-1.470	1.417	0.000	2.042
CHELPG
AIM
ESP

	x	y	z
x	2.568	0.271	0.000
y	0.271	3.626	0.000
z	0.000	0.000	1.154

<r²>	19.461
(<r²>)^1/2	4.411

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: M06-2X/6-31G*

States and conformations

All results from a given calculation for CH₂NH (Methanimine)