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	hartrees
Energy at 0K	-94.608757
Energy at 298.15K
HF Energy	-94.608757
Nuclear repulsion energy	32.418317

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3396	3264	15.53
2	A'	3182	3058	37.08
3	A'	3047	2929	60.56
4	A'	1669	1604	8.42
5	A'	1505	1446	6.34
6	A'	1334	1282	44.37
7	A'	1075	1034	53.65
8	A"	1166	1121	72.39
9	A"	1127	1083	28.96

Atom	x (Å)	y (Å)
C1	0.055	0.601
N2	0.055	-0.693
H3	-0.838	1.243
H4	1.018	1.115
H5	-0.890	-1.113

	C1	N2	H3	H4	H5
C1		1.2934	1.1000	1.0917	1.9567
N2	1.2934		2.1318	2.0482	1.0341
H3	1.1000	2.1318		1.8604	2.3564
H4	1.0917	2.0482	1.8604		2.9331
H5	1.9567	1.0341	2.3564	2.9331

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H5	113.965		N2	C1	H3	125.728
N2	C1	H4	118.104		H3	C1	H4	116.168

All results from a given calculation for CH₂NH (Methanimine)

using model chemistry: B3LYP/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	-0.386
2	N	-0.243
3	H	0.189
4	H	0.211
5	H	0.229

	x	y	z	Total
	-1.708	1.565	0.000	2.317
CHELPG
AIM
ESP

	x	y	z
x	2.410	0.289	0.000
y	0.289	3.726	0.000
z	0.000	0.000	1.156

<r²>	19.992
(<r²>)^1/2	4.471

All results from a given calculation for CH2NH (Methanimine)

using model chemistry: B3LYP/LANL2DZ

States and conformations

All results from a given calculation for CH₂NH (Methanimine)