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	hartrees
Energy at 0K	-94.668693
Energy at 298.15K	-94.671672
HF Energy	-94.668693
Nuclear repulsion energy	32.944714

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3405	3297	2.44
2	A'	3103	3005	37.94
3	A'	3008	2913	54.69
4	A'	1704	1650	19.98
5	A'	1494	1447	5.42
6	A'	1375	1331	44.32
7	A'	1066	1032	37.02
8	A"	1172	1135	45.18
9	A"	1098	1063	15.12

Atom	x (Å)	y (Å)
C1	0.056	0.584
N2	0.056	-0.682
H3	-0.841	1.214
H4	1.011	1.112
H5	-0.896	-1.055

	C1	N2	H3	H4	H5
C1		1.2654	1.0964	1.0914	1.8944
N2	1.2654		2.0975	2.0319	1.0218
H3	1.0964	2.0975		1.8549	2.2694
H4	1.0914	2.0319	1.8549		2.8857
H5	1.8944	1.0218	2.2694	2.8857

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	111.390		N2	C1	H3	125.112
N2	C1	H4	118.930		H3	C1	H4	115.958

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: TPSSh/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	-0.047
2	N	-0.240
3	H	0.054
4	H	0.094
5	H	0.138

	x	y	z	Total
	-1.326	1.386	0.000	1.918
CHELPG
AIM
ESP

	x	y	z
x	2.941	0.196	0.000
y	0.196	4.021	0.000
z	0.000	0.000	1.907

<r²>	19.534
(<r²>)^1/2	4.420

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: TPSSh/cc-pVTZ

States and conformations

All results from a given calculation for CH₂NH (Methanimine)