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	hartrees
Energy at 0K	-94.572653
Energy at 298.15K
HF Energy	-94.572653
Nuclear repulsion energy	32.533829

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3479	3479	12.38
2	A'	3221	3221	37.58
3	A'	3083	3083	58.33
4	A'	1702	1702	10.42
5	A'	1521	1521	7.72
6	A'	1350	1350	45.15
7	A'	1089	1089	55.17
8	A"	1181	1181	71.90
9	A"	1141	1141	32.24

Atom	x (Å)	y (Å)
C1	0.055	0.599
N2	0.055	-0.690
H3	-0.840	1.234
H4	1.015	1.112
H5	-0.885	-1.110

	C1	N2	H3	H4	H5
C1		1.2888	1.0973	1.0888	1.9499
N2	1.2888		2.1219	2.0421	1.0291
H3	1.0973	2.1219		1.8587	2.3444
H4	1.0888	2.0421	1.8587		2.9235
H5	1.9499	1.0291	2.3444	2.9235

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	114.081		N2	C1	H3	125.378
N2	C1	H4	118.141		H3	C1	H4	116.481

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: wB97X-D/LANL2DZ

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	-0.368
2	N	-0.277
3	H	0.187
4	H	0.213
5	H	0.244

	x	y	z	Total
	-1.768	1.611	0.000	2.391
CHELPG
AIM
ESP

	x	y	z
x	2.385	0.278	0.000
y	0.278	3.729	0.000
z	0.000	0.000	1.149

<r²>	19.864
(<r²>)^1/2	4.457

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: wB97X-D/LANL2DZ

States and conformations

All results from a given calculation for CH₂NH (Methanimine)