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	hartrees
Energy at 0K	-94.542001
Energy at 298.15K
HF Energy	-94.542001
Nuclear repulsion energy	32.749661

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3423	3423	6.91
2	A'	3227	3227	32.76
3	A'	3103	3103	31.90
4	A'	1744	1744	17.71
5	A'	1538	1538	6.31
6	A'	1368	1368	45.40
7	A'	1082	1082	55.74
8	A"	1191	1191	64.98
9	A"	1139	1139	25.74

Atom	x (Å)	y (Å)
C1	0.055	0.593
N2	0.055	-0.684
H3	-0.837	1.226
H4	1.011	1.109
H5	-0.885	-1.103

	C1	N2	H3	H4	H5
C1		1.2768	1.0931	1.0862	1.9384
N2	1.2768		2.1074	2.0315	1.0286
H3	1.0931	2.1074		1.8511	2.3288
H4	1.0862	2.0315	1.8511		2.9124
H5	1.9384	1.0286	2.3288	2.9124

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	114.020		N2	C1	H3	125.368
N2	C1	H4	118.345		H3	C1	H4	116.287

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	-0.139
2	N	-0.447
3	H	0.139
4	H	0.169
5	H	0.279

	x	y	z	Total
	-1.716	1.457	0.000	2.251
CHELPG
AIM
ESP

	x	y	z
x	2.467	0.297	0.000
y	0.297	3.728	0.000
z	0.000	0.000	1.013

<r²>	19.743
(<r²>)^1/2	4.443

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)