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	hartrees
Energy at 0K	-132.397067
Energy at 298.15K	-132.399715
HF Energy	-131.930576
Nuclear repulsion energy	60.041404

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3637	3637	41.31
2	A'	3277	3277	11.16
3	A'	2190	2190	461.96
4	A'	1507	1507	2.41
5	A'	1204	1204	22.84
6	A'	1073	1073	209.49
7	A'	779	779	93.15
8	A'	505	505	24.50
9	A"	3375	3375	1.24
10	A"	1046	1046	0.01
11	A"	943	943	56.14
12	A"	438	438	0.02

Atom	x (Å)	y (Å)	z (Å)
C1	-0.076	-1.241	0.000
C2	0.000	0.060	0.000
N3	-0.031	1.274	0.000
H4	-0.100	-1.775	0.929
H5	-0.100	-1.775	-0.929
H6	0.872	1.722	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3029	2.5152	1.0721	1.0721	3.1115
C2	1.3029		1.2145	2.0592	2.0592	1.8777
N3	2.5152	1.2145		3.1882	3.1882	1.0083
H4	1.0721	2.0592	3.1882		1.8584	3.7475
H5	1.0721	2.0592	3.1882	1.8584		3.7475
H6	3.1115	1.8777	1.0083	3.7475	3.7475

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	175.205	C2	C1	H4	119.920
C2	C1	H5	119.920	C2	N3	H6	114.978
H4	C1	H5	120.154

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: CID/Def2TZVPP

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: CID/Def2TZVPP

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)