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	hartrees
Energy at 0K	-94.573641
Energy at 298.15K
HF Energy	-94.573641
Nuclear repulsion energy	32.696058

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3346	3346	9.95
2	A'	3069	3069	49.98
3	A'	2957	2957	64.84
4	A'	1682	1682	22.35
5	A'	1477	1477	2.78
6	A'	1356	1356	42.96
7	A'	1060	1060	34.81
8	A"	1148	1148	46.54
9	A"	1060	1060	11.53

Atom	x (Å)	y (Å)
C1	0.056	0.587
N2	0.056	-0.690
H3	-0.837	1.236
H4	1.021	1.111
H5	-0.914	-1.038

	C1	N2	H3	H4	H5
C1		1.2773	1.1042	1.0983	1.8923
N2	1.2773		2.1231	2.0438	1.0305
H3	1.1042	2.1231		1.8629	2.2745
H4	1.0983	2.0438	1.8629		2.8919
H5	1.8923	1.0305	2.2745	2.8919

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	109.696		N2	C1	H3	125.971
N2	C1	H4	118.511		H3	C1	H4	115.518

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: B97D3/6-31G**

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	-0.032
2	N	-0.418
3	H	0.095
4	H	0.120
5	H	0.235

	x	y	z	Total
	-1.359	1.326	0.000	1.899
CHELPG
AIM
ESP

	x	y	z
x	2.698	0.267	0.000
y	0.267	3.754	0.000
z	0.000	0.000	1.220

<r²>	19.608
(<r²>)^1/2	4.428

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: B97D3/6-31G**

States and conformations

All results from a given calculation for CH₂NH (Methanimine)