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	hartrees
Energy at 0K	-132.396225
Energy at 298.15K	-132.398878
HF Energy	-131.925461
Nuclear repulsion energy	59.993274

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3625	3371	35.53
2	A'	3272	3042	10.44
3	A'	2185	2031	437.11
4	A'	1503	1398	2.59
5	A'	1199	1115	23.57
6	A'	1077	1001	208.00
7	A'	781	726	93.08
8	A'	504	469	23.51
9	A"	3368	3132	0.94
10	A"	1045	972	0.00
11	A"	943	877	54.35
12	A"	436	405	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	-0.062	-1.243	0.000
C2	0.000	0.059	0.000
N3	-0.046	1.275	0.000
H4	-0.080	-1.777	0.929
H5	-0.080	-1.777	-0.929
H6	0.854	1.731	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3033	2.5175	1.0722	1.0722	3.1112
C2	1.3033		1.2165	2.0597	2.0597	1.8771
N3	2.5175	1.2165		3.1905	3.1905	1.0090
H4	1.0722	2.0597	3.1905		1.8587	3.7472
H5	1.0722	2.0597	3.1905	1.8587		3.7472
H6	3.1112	1.8771	1.0090	3.7472	3.7472

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	175.108	C2	C1	H4	119.915
C2	C1	H5	119.915	C2	N3	H6	114.690
H4	C1	H5	120.164

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: CISD/cc-pVTZ

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/cc-pVTZ

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)