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	hartrees
Energy at 0K	-93.384147
Energy at 298.15K
HF Energy	-93.384147
Nuclear repulsion energy	32.095880

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3518	3518	15.24
2	A'	3490	3490	4.64
3	A'	3340	3340	0.99
4	A'	1794	1794	4.66
5	A'	1574	1574	0.06
6	A'	1491	1491	30.84
7	A'	1124	1124	18.51
8	A"	1241	1241	23.86
9	A"	1081	1081	12.55

Atom	x (Å)	y (Å)
C1	0.060	0.598
N2	0.060	-0.707
H3	-0.833	1.252
H4	1.031	1.121
H5	-0.971	-1.011

	C1	N2	H3	H4	H5
C1		1.3050	1.1063	1.1028	1.9113
N2	1.3050		2.1524	2.0697	1.0750
H3	1.1063	2.1524		1.8681	2.2673
H4	1.1028	2.0697	1.8681		2.9247
H5	1.9113	1.0750	2.2673	2.9247

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	106.446		N2	C1	H3	126.222
N2	C1	H4	118.297		H3	C1	H4	115.481

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: wB97X-D/STO-3G

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	-0.055
2	N	-0.264
3	H	0.075
4	H	0.087
5	H	0.156

	x	y	z	Total
	-1.352	1.209	0.000	1.813
CHELPG
AIM
ESP

	x	y	z
x	1.419	0.377	0.000
y	0.377	2.135	0.000
z	0.000	0.000	0.448

<r²>	19.516
(<r²>)^1/2	4.418

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: wB97X-D/STO-3G

States and conformations

All results from a given calculation for CH₂NH (Methanimine)