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	hartrees
Energy at 0K	-22.758807
Energy at 298.15K	-22.761272
HF Energy	-22.344945
Nuclear repulsion energy	31.437799

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3479	3315	13.55
2	A'	3204	3053	7.11
3	A'	2050	1953	271.73
4	A'	1452	1383	4.47
5	A'	1126	1072	33.37
6	A'	1051	1002	204.64
7	A'	647	617	124.10
8	A'	435	415	21.39
9	A"	3314	3158	0.31
10	A"	1010	963	0.01
11	A"	914	871	60.48
12	A"	401	382	1.16

Atom	x (Å)	y (Å)	z (Å)
C1	0.349	-1.222	0.000
C2	0.000	0.061	0.000
N3	-0.477	1.214	0.000
H4	0.505	-1.740	0.939
H5	0.505	-1.740	-0.939
H6	0.237	1.952	0.000

	C1	C2	N3	H4	H5	H6
C1		1.3293	2.5718	1.0837	1.0837	3.1754
C2	1.3293		1.2477	2.0925	2.0925	1.9055
N3	2.5718	1.2477		3.2509	3.2509	1.0267
H4	1.0837	2.0925	3.2509		1.8784	3.8184
H5	1.0837	2.0925	3.2509	1.8784		3.8184
H6	3.1754	1.9055	1.0267	3.8184	3.8184

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	172.739	C2	C1	H4	119.922
C2	C1	H5	119.922	C2	N3	H6	113.469
H4	C1	H5	120.135

All results from a given calculation for H₂CCNH (Ethenimine)

using model chemistry: MP2/CEP-121G*

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: MP2/CEP-121G*

States and conformations

All results from a given calculation for H₂CCNH (Ethenimine)