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	hartrees
Energy at 0K	-132.338326
Energy at 298.15K	-132.340866
HF Energy	-131.884462
Nuclear repulsion energy	58.890450

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3481	3481	8.85
2	A'	3209	3209	5.34
3	A'	2121	2121	267.38
4	A'	1453	1453	1.32
5	A'	1157	1157	40.46
6	A'	1084	1084	152.94
7	A'	721	721	81.54
8	A'	455	455	18.21
9	A"	3315	3315	0.18
10	A"	1010	1010	0.09
11	A"	925	925	46.52
12	A"	404	404	0.16

Atom	x (Å)	y (Å)	z (Å)
C1	0.007	-1.266	0.000
C2	0.000	0.061	0.000
N3	-0.124	1.296	0.000
H4	0.018	-1.812	0.946
H5	0.018	-1.812	-0.946
H6	0.786	1.778	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3270	2.5656	1.0920	1.0920	3.1419
C2	1.3270		1.2415	2.0982	2.0982	1.8883
N3	2.5656	1.2415		3.2520	3.2520	1.0293
H4	1.0920	2.0982	3.2520		1.8915	3.7908
H5	1.0920	2.0982	3.2520	1.8915		3.7908
H6	3.1419	1.8883	1.0293	3.7908	3.7908

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	174.591	C2	C1	H4	119.997
C2	C1	H5	119.997	C2	N3	H6	112.176
H4	C1	H5	119.998

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: CCSD=FULL/cc-pVDZ

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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All results from a given calculation for H2CCNH (Ethenimine)

using model chemistry: CCSD=FULL/cc-pVDZ

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)