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	hartrees
Energy at 0K	-94.635883
Energy at 298.15K
HF Energy	-94.635883
Nuclear repulsion energy	32.738378

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3309	3298	3.01
2	A'	3026	3016	31.65
3	A'	2928	2918	61.68
4	A'	1638	1633	19.18
5	A'	1449	1444	5.41
6	A'	1333	1329	40.93
7	A'	1046	1042	33.69
8	A"	1129	1125	40.56
9	A"	1055	1052	16.83

Atom	x (Å)	y (Å)
C1	0.056	0.589
N2	0.056	-0.687
H3	-0.846	1.219
H4	1.017	1.114
H5	-0.904	-1.058

	C1	N2	H3	H4	H5
C1		1.2757	1.1007	1.0955	1.9060
N2	1.2757		2.1089	2.0417	1.0296
H3	1.1007	2.1089		1.8663	2.2775
H4	1.0955	2.0417	1.8663		2.9001
H5	1.9060	1.0296	2.2775	2.9001

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	111.098		N2	C1	H3	124.944
N2	C1	H4	118.675		H3	C1	H4	116.382

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: BLYP/aug-cc-pVTZ

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	-0.417
2	N	-0.385
3	H	0.329
4	H	0.355
5	H	0.118

	x	y	z	Total
	-1.320	1.441	0.000	1.954
CHELPG
AIM
ESP

	x	y	z
x	3.497	0.087	0.000
y	0.087	4.590	0.000
z	0.000	0.000	2.668

<r²>	19.977
(<r²>)^1/2	4.470

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: BLYP/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₂NH (Methanimine)