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	hartrees
Energy at 0K	-133.267250
Energy at 298.15K	-133.273353
HF Energy	-132.979451
Nuclear repulsion energy	73.770014

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3440	3321	5.63
2	A'	3268	3155	34.43
3	A'	3148	3038	15.21
4	A'	1541	1487	0.61
5	A'	1284	1240	9.53
6	A'	1211	1169	16.02
7	A'	1131	1092	5.50
8	A'	1013	978	11.43
9	A'	844	815	3.81
10	A'	740	715	68.69
11	A"	3254	3141	0.94
12	A"	3138	3029	30.95
13	A"	1526	1473	0.81
14	A"	1282	1237	11.62
15	A"	1190	1149	10.46
16	A"	1140	1100	5.71
17	A"	920	888	16.34
18	A"	766	740	1.05

Atom	x (Å)	y (Å)	z (Å)
N1	-0.038	0.916	0.000
H2	0.899	1.354	0.000
C3	-0.038	-0.422	0.764
C4	-0.038	-0.422	-0.764
H5	-0.967	-0.625	1.300
H6	0.879	-0.728	1.278
H7	-0.967	-0.625	-1.300
H8	0.879	-0.728	-1.278

	N1	H2	C3	C4	H5	H6	H7	H8
N1		1.0340	1.5409	1.5409	2.2198	2.2757	2.2198	2.2757
H2	1.0340		2.1486	2.1486	3.0143	2.4437	3.0143	2.4437
C3	1.5409	2.1486		1.5279	1.0913	1.0949	2.2726	2.2595
C4	1.5409	2.1486	1.5279		2.2726	2.2595	1.0913	1.0949
H5	2.2198	3.0143	1.0913	2.2726		1.8482	2.6008	3.1726
H6	2.2757	2.4437	1.0949	2.2595	1.8482		3.1726	2.5566
H7	2.2198	3.0143	2.2726	1.0913	2.6008	3.1726		1.8482
H8	2.2757	2.4437	2.2595	1.0949	3.1726	2.5566	1.8482

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C3	C4	60.278	N1	C3	H5	113.892
N1	C3	H6	118.416	N1	C4	C3	60.278
N1	C4	H7	113.892	N1	C4	H8	118.416
H2	N1	C3	111.590	H2	N1	C4	111.590
C3	N1	C4	59.444	C3	C4	H7	119.443
C3	C4	H8	118.020	C4	C3	H5	119.443
C4	C3	H6	118.020	H5	C3	H6	115.434
H7	C4	H8	115.434

All results from a given calculation for C₂H₅N (Aziridine)

using model chemistry: MP2/SDD

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/SDD

States and conformations

All results from a given calculation for C₂H₅N (Aziridine)