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	hartrees
Energy at 0K	-94.634777
Energy at 298.15K
HF Energy	-94.634777
Nuclear repulsion energy	32.816227

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3410	3269	7.79
2	A'	3141	3011	44.00
3	A'	3032	2907	54.57
4	A'	1723	1652	22.78
5	A'	1511	1449	3.52
6	A'	1384	1327	43.32
7	A'	1074	1030	37.06
8	A"	1177	1129	49.87
9	A"	1092	1047	12.64

Atom	x (Å)	y (Å)
C1	0.056	0.586
N2	0.056	-0.687
H3	-0.836	1.226
H4	1.017	1.107
H5	-0.910	-1.038

	C1	N2	H3	H4	H5
C1		1.2734	1.0979	1.0924	1.8894
N2	1.2734		2.1111	2.0348	1.0273
H3	1.0979	2.1111		1.8563	2.2653
H4	1.0924	2.0348	1.8563		2.8825
H5	1.8894	1.0273	2.2653	2.8825

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	109.960		N2	C1	H3	125.659
N2	C1	H4	118.456		H3	C1	H4	115.885

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: TPSSh/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	-0.044
2	N	-0.443
3	H	0.108
4	H	0.132
5	H	0.247

	x	y	z	Total
	-1.399	1.385	0.000	1.969
CHELPG
AIM
ESP

	x	y	z
x	2.646	0.276	0.000
y	0.276	3.717	0.000
z	0.000	0.000	1.207

<r²>	19.518
(<r²>)^1/2	4.418

All results from a given calculation for CH2NH (Methanimine)

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

States and conformations

All results from a given calculation for CH₂NH (Methanimine)