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	hartrees
Energy at 0K	-133.515936
Energy at 298.15K	-133.522154
HF Energy	-133.048091
Nuclear repulsion energy	76.329473

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3594	3358	0.14
2	A'	3326	3108	28.38
3	A'	3224	3012	12.03
4	A'	1592	1488	1.57
5	A'	1335	1248	4.38
6	A'	1285	1200	17.46
7	A'	1162	1085	5.66
8	A'	1041	972	10.94
9	A'	913	853	47.79
10	A'	801	749	25.74
11	A"	3314	3097	0.43
12	A"	3217	3006	22.36
13	A"	1558	1456	0.19
14	A"	1305	1220	9.20
15	A"	1197	1118	3.03
16	A"	1143	1068	2.31
17	A"	942	880	13.77
18	A"	903	844	0.04

Atom	x (Å)	y (Å)	z (Å)
N1	-0.038	0.875	0.000
H2	0.901	1.260	0.000
C3	-0.038	-0.397	0.739
C4	-0.038	-0.397	-0.739
H5	-0.951	-0.605	1.277
H6	0.867	-0.706	1.243
H7	-0.951	-0.605	-1.277
H8	0.867	-0.706	-1.243

	N1	H2	C3	C4	H5	H6	H7	H8
N1		1.0154	1.4704	1.4704	2.1570	2.2054	2.1570	2.2054
H2	1.0154		2.0427	2.0427	2.9221	2.3265	2.9221	2.3265
C3	1.4704	2.0427		1.4777	1.0797	1.0813	2.2222	2.2007
C4	1.4704	2.0427	1.4777		2.2222	2.2007	1.0797	1.0813
H5	2.1570	2.9221	1.0797	2.2222		1.8209	2.5530	3.1084
H6	2.2054	2.3265	1.0813	2.2007	1.8209		3.1084	2.4860
H7	2.1570	2.9221	2.2222	1.0797	2.5530	3.1084		1.8209
H8	2.2054	2.3265	2.2007	1.0813	3.1084	2.4860	1.8209

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C4	59.834	N1	C3	H5	114.665
N1	C3	H6	118.819	N1	C4	C3	59.834
N1	C4	H7	114.665	N1	C4	H8	118.819
H2	N1	C3	109.149	H2	N1	C4	109.149
C3	N1	C4	60.331	C3	C4	H7	119.865
C3	C4	H8	117.790	C4	C3	H5	119.865
C4	C3	H6	117.790	H5	C3	H6	114.836
H7	C4	H8	114.836

All results from a given calculation for C₂H₅N (Aziridine)

using model chemistry: MP2=FULL/6-31G**

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/6-31G**

States and conformations

All results from a given calculation for C₂H₅N (Aziridine)