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	hartrees
Energy at 0K	-133.565873
Energy at 298.15K	-133.572082
HF Energy	-133.063916
Nuclear repulsion energy	76.162028

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3559	3371	0.35
2	A'	3277	3103	29.17
3	A'	3174	3006	12.69
4	A'	1564	1481	0.56
5	A'	1332	1261	7.33
6	A'	1272	1205	20.05
7	A'	1145	1084	12.77
8	A'	1036	981	8.53
9	A'	903	856	51.60
10	A'	801	759	24.74
11	A"	3265	3092	0.56
12	A"	3167	2999	23.79
13	A"	1532	1451	0.42
14	A"	1305	1236	11.89
15	A"	1183	1121	3.66
16	A"	1125	1066	4.24
17	A"	947	897	14.63
18	A"	890	843	0.18

Atom	x (Å)	y (Å)	z (Å)
N1	-0.038	0.874	0.000
H2	0.898	1.267	0.000
C3	-0.038	-0.398	0.741
C4	-0.038	-0.398	-0.741
H5	-0.956	-0.604	1.279
H6	0.872	-0.705	1.245
H7	-0.956	-0.604	-1.279
H8	0.872	-0.705	-1.245

	N1	H2	C3	C4	H5	H6	H7	H8
N1		1.0152	1.4723	1.4723	2.1592	2.2081	2.1592	2.2081
H2	1.0152		2.0489	2.0489	2.9280	2.3330	2.9280	2.3330
C3	1.4723	2.0489		1.4829	1.0834	1.0854	2.2285	2.2072
C4	1.4723	2.0489	1.4829		2.2285	2.2072	1.0834	1.0854
H5	2.1592	2.9280	1.0834	2.2285		1.8319	2.5574	3.1187
H6	2.2081	2.3330	1.0854	2.2072	1.8319		3.1187	2.4909
H7	2.1592	2.9280	2.2285	1.0834	2.5574	3.1187		1.8319
H8	2.2081	2.3330	2.2072	1.0854	3.1187	2.4909	1.8319

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C4	59.761	N1	C3	H5	114.458
N1	C3	H6	118.597	N1	C4	C3	59.761
N1	C4	H7	114.458	N1	C4	H8	118.597
H2	N1	C3	109.543	H2	N1	C4	109.543
C3	N1	C4	60.477	C3	C4	H7	119.728
C3	C4	H8	117.667	C4	C3	H5	119.728
C4	C3	H6	117.667	H5	C3	H6	115.268
H7	C4	H8	115.268

All results from a given calculation for C₂H₅N (Aziridine)

using model chemistry: MP2=FULL/6-311G*

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 C2H5N (Aziridine)

using model chemistry: MP2=FULL/6-311G*

States and conformations

All results from a given calculation for C₂H₅N (Aziridine)