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	hartrees
Energy at 0K	-186.307119
Energy at 298.15K	-186.312016
HF Energy	-185.892759
Nuclear repulsion energy	101.504542

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3450	3271	0.36
2	A'	3117	2955	9.29
3	A'	2124	2014	10.84
4	A'	1763	1671	20.02
5	A'	1567	1485	8.21
6	A'	1412	1339	0.90
7	A'	1100	1043	29.60
8	A'	874	829	61.72
9	A'	774	734	174.35
10	A'	586	556	15.91
11	A'	227	216	10.10
12	A"	3555	3370	1.12
13	A"	3162	2998	4.54
14	A"	1429	1355	0.29
15	A"	1263	1197	0.01
16	A"	916	868	0.05
17	A"	437	414	20.19
18	A"	308	292	57.38

Atom	x (Å)	y (Å)	z (Å)
N1	-1.484	0.710	0.000
C2	0.000	0.840	0.000
C3	0.742	-0.453	0.000
N4	1.282	-1.511	0.000
H5	-1.815	0.226	0.837
H6	-1.815	0.226	-0.837
H7	0.293	1.416	0.883
H8	0.293	1.416	-0.883

	N1	C2	C3	N4	H5	H6	H7	H8
N1		1.4893	2.5113	3.5479	1.0220	1.0220	2.1056	2.1056
C2	1.4893		1.4908	2.6785	2.0906	2.0906	1.0940	1.0940
C3	2.5113	1.4908		1.1885	2.7746	2.7746	2.1149	2.1149
N4	3.5479	2.6785	1.1885		3.6484	3.6484	3.2136	3.2136
H5	1.0220	2.0906	2.7746	3.6484		1.6735	2.4207	2.9691
H6	1.0220	2.0906	2.7746	3.6484	1.6735		2.9691	2.4207
H7	2.1056	1.0940	2.1149	3.2136	2.4207	2.9691		1.7662
H8	2.1056	1.0940	2.1149	3.2136	2.9691	2.4207	1.7662

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	C3	114.852	N1	C2	H7	108.212
N1	C2	H8	108.212	C2	N1	H5	111.350
C2	N1	H6	111.350	C2	C3	N4	177.193
C3	C2	H7	108.846	C3	C2	H8	108.846
H5	N1	H6	109.921	H7	C2	H8	107.647

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)

using model chemistry: MP2=FULL/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 NH2CH2CN (Aminoacetonitrile)

using model chemistry: MP2=FULL/3-21G*

States and conformations

All results from a given calculation for NH₂CH₂CN (Aminoacetonitrile)