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	hartrees
Energy at 0K	-132.355436
Energy at 298.15K	-132.357977
HF Energy	-131.892629
Nuclear repulsion energy	58.829281

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3486	3359	15.61
2	A'	3191	3074	5.82
3	A'	2089	2012	345.83
4	A'	1446	1393	1.59
5	A'	1145	1103	32.98
6	A'	1072	1033	167.56
7	A'	730	703	79.10
8	A'	454	437	17.46
9	A"	3295	3175	0.11
10	A"	1005	968	1.20
11	A"	911	878	46.63
12	A"	404	389	0.27

Atom	x (Å)	y (Å)	z (Å)
C1	0.130	-1.262	0.000
C2	0.000	0.061	0.000
N3	-0.250	1.278	0.000
H4	0.192	-1.803	0.945
H5	0.192	-1.803	-0.945
H6	0.588	1.870	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3298	2.5687	1.0911	1.0911	3.1656
C2	1.3298		1.2424	2.0993	2.0993	1.9019
N3	2.5687	1.2424		3.2534	3.2534	1.0261
H4	1.0911	2.0993	3.2534		1.8909	3.8135
H5	1.0911	2.0993	3.2534	1.8909		3.8135
H6	3.1656	1.9019	1.0261	3.8135	3.8135

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	173.982	C2	C1	H4	119.936
C2	C1	H5	119.936	C2	N3	H6	113.602
H4	C1	H5	120.118

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: CCSD/aug-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/aug-cc-pVDZ

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)