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	hartrees
Energy at 0K	-132.464494
Energy at 298.15K	-132.467070
HF Energy	-131.926466
Nuclear repulsion energy	59.565284

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3520	3364	25.06
2	A'	3198	3057	8.23
3	A'	2114	2021	383.15
4	A'	1460	1395	2.35
5	A'	1158	1107	23.49
6	A'	1062	1015	192.21
7	A'	737	705	80.78
8	A'	474	453	19.82
9	A"	3293	3147	0.66
10	A"	1014	969	0.40
11	A"	920	879	48.13
12	A"	415	397	0.21

Atom	x (Å)	y (Å)	z (Å)
C1	0.049	-1.252	0.000
C2	0.000	0.059	0.000
N3	-0.164	1.275	0.000
H4	0.077	-1.789	0.934
H5	0.077	-1.789	-0.934
H6	0.697	1.815	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3118	2.5355	1.0784	1.0784	3.1347
C2	1.3118		1.2267	2.0726	2.0726	1.8894
N3	2.5355	1.2267		3.2125	3.2125	1.0165
H4	1.0784	2.0726	3.2125		1.8689	3.7748
H5	1.0784	2.0726	3.2125	1.8689		3.7748
H6	3.1347	1.8894	1.0165	3.7748	3.7748

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	174.468	C2	C1	H4	119.937
C2	C1	H5	119.937	C2	N3	H6	114.443
H4	C1	H5	120.117

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: CCSD/aug-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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All results from a given calculation for H2CCNH (Ethenimine)

using model chemistry: CCSD/aug-cc-pVTZ

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)