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	hartrees
Energy at 0K	-131.410390
Energy at 298.15K	-131.413077
HF Energy	-131.133131
Nuclear repulsion energy	59.329499

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3445	3219	8.01
2	A'	3229	3018	5.09
3	A'	2180	2037	245.37
4	A'	1545	1444	5.80
5	A'	1189	1111	6.56
6	A'	1056	987	371.66
7	A'	845	789	124.60
8	A'	504	471	30.22
9	A"	3310	3093	0.26
10	A"	1112	1039	1.12
11	A"	977	913	67.00
12	A"	452	422	0.73

Atom	x (Å)	y (Å)	z (Å)
C1	-0.173	-1.246	0.000
C2	0.000	0.057	0.000
N3	0.077	1.283	0.000
H4	-0.249	-1.796	0.928
H5	-0.249	-1.796	-0.928
H6	0.992	1.746	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3142	2.5408	1.0813	1.0813	3.2107
C2	1.3142		1.2281	2.0873	2.0873	1.9589
N3	2.5408	1.2281		3.2320	3.2320	1.0252
H4	1.0813	2.0873	3.2320		1.8552	3.8664
H5	1.0813	2.0873	3.2320	1.8552		3.8664
H6	3.2107	1.9589	1.0252	3.8664	3.8664

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	176.067	C2	C1	H4	120.919
C2	C1	H5	120.919	C2	N3	H6	120.500
H4	C1	H5	118.162

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: CISD/3-21G*

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/3-21G*

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)