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	hartrees
Energy at 0K	-17.323124
Energy at 298.15K
HF Energy	-17.323124
Nuclear repulsion energy	18.940352

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3432	3315	6.56
2	A'	3144	3037	49.49
3	A'	3034	2930	67.91
4	A'	1700	1642	27.62
5	A'	1484	1433	6.50
6	A'	1374	1327	37.21
7	A'	1072	1035	30.63
8	A"	1153	1114	54.88
9	A"	1083	1046	20.40

Atom	x (Å)	y (Å)
C1	0.076	0.576
N2	0.076	-0.713
H3	-0.829	1.215
H4	1.043	1.104
H5	-0.898	-1.057

	C1	N2	H3	H4	H5
C1		1.2892	1.1082	1.1022	1.9010
N2	1.2892		2.1305	2.0589	1.0324
H3	1.1082	2.1305		1.8757	2.2733
H4	1.1022	2.0589	1.8757		2.9047
H5	1.9010	1.0324	2.2733	2.9047

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	109.440		N2	C1	H3	125.240
N2	C1	H4	118.646		H3	C1	H4	116.114

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: B3LYP/CEP-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	-0.532
2	N	-0.092
3	H	0.187
4	H	0.203
5	H	0.234

	x	y	z	Total
	-1.507	1.586	0.000	2.188
CHELPG
AIM
ESP

	x	y	z
x	2.432	0.275	-0.000
y	0.275	3.662	0.000
z	-0.000	0.000	1.506

<r²>	18.121
(<r²>)^1/2	4.257

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: B3LYP/CEP-31G*

States and conformations

All results from a given calculation for CH₂NH (Methanimine)