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	hartrees
Energy at 0K	-94.591382
Energy at 298.15K
HF Energy	-94.591382
Nuclear repulsion energy	32.774198

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3328	3328	13.33
2	A'	3045	3045	55.76
3	A'	2933	2933	81.66
4	A'	1673	1673	21.75
5	A'	1477	1477	3.93
6	A'	1370	1370	44.01
7	A'	1073	1073	33.81
8	A"	1158	1158	50.70
9	A"	1056	1056	15.33

Atom	x (Å)	y (Å)
C1	0.056	0.586
N2	0.056	-0.687
H3	-0.840	1.231
H4	1.021	1.109
H5	-0.910	-1.041

	C1	N2	H3	H4	H5
C1		1.2730	1.1039	1.0975	1.8918
N2	1.2730		2.1171	2.0387	1.0288
H3	1.1039	2.1171		1.8646	2.2729
H4	1.0975	2.0387	1.8646		2.8895
H5	1.8918	1.0288	2.2729	2.8895

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	110.102		N2	C1	H3	125.770
N2	C1	H4	118.458		H3	C1	H4	115.772

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: B97D3/6-311G*

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	-0.232
2	N	-0.409
3	H	0.171
4	H	0.200
5	H	0.270

	x	y	z	Total
	-1.406	1.350	0.000	1.949
CHELPG
AIM
ESP

	x	y	z
x	2.723	0.210	0.000
y	0.210	3.878	0.000
z	0.000	0.000	1.463

<r²>	19.665
(<r²>)^1/2	4.434

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: B97D3/6-311G*

States and conformations

All results from a given calculation for CH₂NH (Methanimine)