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	hartrees
Energy at 0K	-23.945749
Energy at 298.15K	-23.951925
HF Energy	-23.515316
Nuclear repulsion energy	43.013909

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3505	3339	0.67
2	A'	3275	3120	33.27
3	A'	3164	3015	14.14
4	A'	1553	1479	0.94
5	A'	1315	1253	9.84
6	A'	1250	1191	13.37
7	A'	1139	1085	8.29
8	A'	1031	982	11.96
9	A'	881	839	52.79
10	A'	789	752	22.84
11	A"	3263	3109	0.75
12	A"	3157	3008	28.42
13	A"	1524	1452	0.00
14	A"	1290	1229	12.23
15	A"	1177	1122	3.80
16	A"	1111	1059	4.66
17	A"	928	884	14.30
18	A"	860	819	0.07

Atom	x (Å)	y (Å)	z (Å)
N1	-0.052	0.897	0.000
H2	0.901	1.269	0.000
C3	-0.052	-0.395	0.748
C4	-0.052	-0.395	-0.748
H5	-0.975	-0.599	1.283
H6	0.861	-0.697	1.256
H7	-0.975	-0.599	-1.283
H8	0.861	-0.697	-1.256

	N1	H2	C3	C4	H5	H6	H7	H8
N1		1.0235	1.4933	1.4933	2.1760	2.2257	2.1760	2.2257
H2	1.0235		2.0592	2.0592	2.9421	2.3339	2.9421	2.3339
C3	1.4933	2.0592		1.4957	1.0857	1.0879	2.2397	2.2229
C4	1.4933	2.0592	1.4957		2.2397	2.2229	1.0857	1.0879
H5	2.1760	2.9421	1.0857	2.2397		1.8388	2.5657	3.1348
H6	2.2257	2.3339	1.0879	2.2229	1.8388		3.1348	2.5122
H7	2.1760	2.9421	2.2397	1.0857	2.5657	3.1348		1.8388
H8	2.2257	2.3339	2.2229	1.0879	3.1348	2.5122	1.8388

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C4	59.947	N1	C3	H5	114.138
N1	C3	H6	118.296	N1	C4	C3	59.947
N1	C4	H7	114.138	N1	C4	H8	118.296
H2	N1	C3	108.353	H2	N1	C4	108.353
C3	N1	C4	60.107	C3	C4	H7	119.522
C3	C4	H8	117.850	C4	C3	H5	119.522
C4	C3	H6	117.850	H5	C3	H6	115.547
H7	C4	H8	115.547

All results from a given calculation for C₂H₅N (Aziridine)

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 C2H5N (Aziridine)

using model chemistry: MP2/CEP-121G*

States and conformations

All results from a given calculation for C₂H₅N (Aziridine)