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	hartrees
Energy at 0K	-94.063823
Energy at 298.15K
HF Energy	-94.063823
Nuclear repulsion energy	32.751521

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3354	3354	8.63
2	A'	3172	3172	36.73
3	A'	3055	3055	38.50
4	A'	1717	1717	7.93
5	A'	1541	1541	3.39
6	A'	1380	1380	66.43
7	A'	1111	1111	52.26
8	A"	1198	1198	57.20
9	A"	1126	1126	28.99

Atom	x (Å)	y (Å)
C1	0.055	0.590
N2	0.055	-0.685
H3	-0.830	1.235
H4	1.011	1.110
H5	-0.897	-1.089

	C1	N2	H3	H4	H5
C1		1.2745	1.0952	1.0883	1.9300
N2	1.2745		2.1138	2.0337	1.0342
H3	1.0952	2.1138		1.8449	2.3250
H4	1.0883	2.0337	1.8449		2.9116
H5	1.9300	1.0342	2.3250	2.9116

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	113.019		N2	C1	H3	126.091
N2	C1	H4	118.580		H3	C1	H4	115.329

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: wB97X-D/3-21G

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	-0.177
2	N	-0.507
3	H	0.186
4	H	0.221
5	H	0.277

	x	y	z	Total
	-1.604	1.309	0.000	2.070
CHELPG
AIM
ESP

	x	y	z
x	2.300	0.326	0.000
y	0.326	3.423	0.000
z	0.000	0.000	0.882

<r²>	19.593
(<r²>)^1/2	4.426

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: wB97X-D/3-21G

States and conformations

All results from a given calculation for CH₂NH (Methanimine)