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	hartrees
Energy at 0K	-132.333027
Energy at 298.15K	-132.335556
HF Energy	-131.884103
Nuclear repulsion energy	58.810957

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3478	3337	8.69
2	A'	3202	3072	5.30
3	A'	2109	2024	264.70
4	A'	1449	1390	1.41
5	A'	1151	1104	42.19
6	A'	1080	1037	153.57
7	A'	714	685	81.70
8	A'	451	433	18.01
9	A"	3308	3173	0.14
10	A"	1007	967	0.10
11	A"	919	882	46.51
12	A"	401	385	0.17

Atom	x (Å)	y (Å)	z (Å)
C1	0.040	-1.267	0.000
C2	0.000	0.061	0.000
N3	-0.158	1.294	0.000
H4	0.065	-1.813	0.947
H5	0.065	-1.813	-0.947
H6	0.738	1.803	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3288	2.5692	1.0931	1.0931	3.1480
C2	1.3288		1.2435	2.1006	2.1006	1.8913
N3	2.5692	1.2435		3.2561	3.2561	1.0299
H4	1.0931	2.1006	3.2561		1.8934	3.7975
H5	1.0931	2.1006	3.2561	1.8934		3.7975
H6	3.1480	1.8913	1.0299	3.7975	3.7975

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	174.415	C2	C1	H4	119.990
C2	C1	H5	119.990	C2	N3	H6	112.251
H4	C1	H5	120.012

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: QCISD/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: QCISD/cc-pVDZ

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)