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	hartrees
Energy at 0K	-172.281206
Energy at 298.15K	-172.289566
Nuclear repulsion energy	124.377014

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3407	3288	3.34
2	A	3273	3158	14.07
3	A	3173	3062	5.40
4	A	3063	2956	63.91
5	A	1715	1655	8.45
6	A	1516	1463	8.53
7	A	1412	1363	27.51
8	A	1213	1170	3.01
9	A	1175	1134	1.11
10	A	1073	1035	29.01
11	A	994	959	1.03
12	A	817	788	0.85
13	A	776	748	6.04
14	A	662	639	207.79
15	A	402	388	5.56
16	A	3500	3377	0.19
17	A	3258	3143	0.18
18	A	3167	3056	14.65
19	A	1496	1443	4.97
20	A	1284	1238	1.24
21	A	1216	1173	0.03
22	A	1150	1110	0.25
23	A	1100	1062	4.97
24	A	886	855	2.00
25	A	838	809	7.91
26	A	404	390	11.50
27	A	282	272	42.82

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.550	0.000
H2	-0.424	1.557	0.000
N3	1.437	0.365	0.000
C4	-0.799	-0.499	0.763
C5	-0.799	-0.499	-0.763
H6	1.887	0.734	0.842
H7	1.887	0.734	-0.842
H8	-1.699	-0.184	1.277
H9	-1.699	-0.184	-1.277
H10	-0.209	-1.266	1.246
H11	-0.209	-1.266	-1.246

	C1	H2	N3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.0929	1.4484	1.5231	1.5231	2.0739	2.0739	2.2483	2.2483	2.2128	2.2128
H2	1.0929		2.2098	2.2244	2.2244	2.5934	2.5934	2.5069	2.5069	3.0938	3.0938
N3	1.4484	2.2098		2.5151	2.5151	1.0231	1.0231	3.4297	3.4297	2.6314	2.6314
C4	1.5231	2.2244	2.5151		1.5255	2.9559	3.3623	1.0833	2.2514	1.0821	2.2301
C5	1.5231	2.2244	2.5151	1.5255		3.3623	2.9559	2.2514	1.0833	2.2301	1.0821
H6	2.0739	2.5934	1.0231	2.9559	3.3623		1.6831	3.7265	4.2644	2.9254	3.5712
H7	2.0739	2.5934	1.0231	3.3623	2.9559	1.6831		4.2644	3.7265	3.5712	2.9254
H8	2.2483	2.5069	3.4297	1.0833	2.2514	3.7265	4.2644		2.5535	1.8419	3.1237
H9	2.2483	2.5069	3.4297	2.2514	1.0833	4.2644	3.7265	2.5535		3.1237	1.8419
H10	2.2128	3.0938	2.6314	1.0821	2.2301	2.9254	3.5712	1.8419	3.1237		2.4926
H11	2.2128	3.0938	2.6314	2.2301	1.0821	3.5712	2.9254	3.1237	1.8419	2.4926

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H6	112.970	C1	N3	H7	112.970
C1	C4	C5	59.947	C1	C4	H8	118.243
C1	C4	H10	115.239	C1	C5	C4	59.947
C1	C5	H9	118.243	C1	C5	H11	115.239
H2	C1	N3	120.178	H2	C1	C4	115.515
H2	C1	C5	115.515	N3	C1	C4	115.625
N3	C1	C5	115.625	C4	C1	C5	60.105
C4	C5	H9	118.327	C4	C5	H11	116.542
C5	C4	H8	118.327	C5	C4	H10	116.542
H6	N3	H7	110.685	H8	C4	H10	116.555
H9	C5	H11	116.555

All results from a given calculation for C₃H₇N (Cyclopropylamine)

using model chemistry: B3LYP/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 C3H7N (Cyclopropylamine)

using model chemistry: B3LYP/3-21G

States and conformations

All results from a given calculation for C₃H₇N (Cyclopropylamine)