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	hartrees
Energy at 0K	-94.600679
Energy at 298.15K
HF Energy	-94.600679
Nuclear repulsion energy	32.980813

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3496	3496	0.42
2	A'	3149	3149	35.68
3	A'	3048	3048	41.53
4	A'	1748	1748	23.65
5	A'	1503	1503	5.35
6	A'	1376	1376	45.49
7	A'	1083	1083	37.10
8	A"	1181	1181	45.03
9	A"	1107	1107	12.82

Atom	x (Å)	y (Å)
C1	0.056	0.582
N2	0.056	-0.682
H3	-0.841	1.213
H4	1.013	1.109
H5	-0.901	-1.040

	C1	N2	H3	H4	H5
C1		1.2649	1.0964	1.0923	1.8834
N2	1.2649		2.0969	2.0310	1.0213
H3	1.0964	2.0969		1.8569	2.2535
H4	1.0923	2.0310	1.8569		2.8774
H5	1.8834	1.0213	2.2535	2.8774

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	110.486		N2	C1	H3	125.100
N2	C1	H4	118.818		H3	C1	H4	116.082

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: wB97X-D/6-31G(2df,p)

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	-0.181
2	N	-0.348
3	H	0.130
4	H	0.146
5	H	0.254

	x	y	z	Total
	-1.343	1.393	0.000	1.935
CHELPG
AIM
ESP

	x	y	z
x	2.685	0.264	0.000
y	0.264	3.667	0.000
z	0.000	0.000	1.526

<r²>	19.337
(<r²>)^1/2	4.397

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: wB97X-D/6-31G(2df,p)

States and conformations

All results from a given calculation for CH₂NH (Methanimine)