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	hartrees
Energy at 0K	-132.328985
Energy at 298.15K	-132.331522
HF Energy	-131.877533
Nuclear repulsion energy	59.200540

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3549	3341	5.17
2	A'	3254	3064	3.97
3	A'	2133	2008	251.38
4	A'	1496	1408	0.91
5	A'	1167	1098	35.19
6	A'	1086	1022	182.97
7	A'	740	697	84.51
8	A'	441	415	18.17
9	A"	3354	3157	0.06
10	A"	1035	975	0.00
11	A"	940	885	54.13
12	A"	405	381	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	0.089	-1.257	0.000
C2	0.000	0.058	0.000
N3	-0.206	1.280	0.000
H4	0.134	-1.799	0.932
H5	0.134	-1.799	-0.932
H6	0.646	1.839	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3181	2.5541	1.0785	1.0785	3.1464
C2	1.3181		1.2392	2.0815	2.0815	1.8950
N3	2.5541	1.2392		3.2342	3.2342	1.0195
H4	1.0785	2.0815	3.2342		1.8634	3.7903
H5	1.0785	2.0815	3.2342	1.8634		3.7903
H6	3.1464	1.8950	1.0195	3.7903	3.7903

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	174.267	C2	C1	H4	120.242
C2	C1	H5	120.242	C2	N3	H6	113.711
H4	C1	H5	119.507

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: QCISD/6-31G**

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: QCISD/6-31G**

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)