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	hartrees
Energy at 0K	-132.393344
Energy at 298.15K	-132.395983
HF Energy	-131.924333
Nuclear repulsion energy	59.996606

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3640	3355	42.74
2	A'	3266	3011	11.57
3	A'	2179	2008	481.14
4	A'	1498	1381	2.49
5	A'	1197	1104	22.97
6	A'	1065	982	207.48
7	A'	772	712	88.55
8	A'	502	462	24.09
9	A"	3366	3102	1.13
10	A"	1040	959	0.02
11	A"	939	865	54.38
12	A"	435	401	0.07

Atom	x (Å)	y (Å)	z (Å)
C1	-0.035	-1.244	0.000
C2	0.000	0.059	0.000
N3	-0.073	1.272	0.000
H4	-0.043	-1.779	0.930
H5	-0.043	-1.779	-0.930
H6	0.811	1.758	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3032	2.5163	1.0731	1.0731	3.1192
C2	1.3032		1.2155	2.0605	2.0605	1.8830
N3	2.5163	1.2155		3.1903	3.1903	1.0095
H4	1.0731	2.0605	3.1903		1.8598	3.7561
H5	1.0731	2.0605	3.1903	1.8598		3.7561
H6	3.1192	1.8830	1.0095	3.7561	3.7561

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	174.981	C2	C1	H4	119.937
C2	C1	H5	119.937	C2	N3	H6	115.317
H4	C1	H5	120.119

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: CISD/6-311+G(3df,2p)

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: CISD/6-311+G(3df,2p)

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)