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	hartrees
Energy at 0K	-172.672182
Energy at 298.15K	-172.680721
HF Energy	-172.081011
Nuclear repulsion energy	125.063389

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3497	3310	1.25
2	A'	3278	3103	16.92
3	A'	3188	3018	5.68
4	A'	3123	2956	44.90
5	A'	1726	1634	19.29
6	A'	1570	1486	14.64
7	A'	1468	1389	15.02
8	A'	1285	1216	0.33
9	A'	1217	1152	10.14
10	A'	1114	1054	14.65
11	A'	1054	997	10.87
12	A'	915	866	134.87
13	A'	851	806	16.30
14	A'	801	758	2.52
15	A'	420	398	7.21
16	A"	3585	3393	0.02
17	A"	3267	3093	0.25
18	A"	3181	3011	15.87
19	A"	1506	1426	1.70
20	A"	1319	1248	1.06
21	A"	1236	1170	0.11
22	A"	1175	1112	0.46
23	A"	1117	1057	1.32
24	A"	947	897	10.35
25	A"	875	829	2.60
26	A"	409	388	9.94
27	A"	291	276	40.67

Atom	x (Å)	y (Å)	z (Å)
C1	-0.312	0.409	0.000
H2	-1.272	0.938	0.000
N3	0.893	1.200	0.000
C4	-0.312	-0.890	0.752
C5	-0.312	-0.890	-0.752
H6	0.931	1.795	0.824
H7	0.931	1.795	-0.824
H8	-1.217	-1.183	1.279
H9	-1.217	-1.183	-1.279
H10	0.603	-1.168	1.268
H11	0.603	-1.168	-1.268

	C1	H2	N3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.0962	1.4416	1.5013	1.5013	2.0356	2.0356	2.2339	2.2339	2.2207	2.2207
H2	1.0962		2.1813	2.1977	2.1977	2.5031	2.5031	2.4773	2.4773	3.0916	3.0916
N3	1.4416	2.1813		2.5273	2.5273	1.0171	1.0171	3.4305	3.4305	2.7012	2.7012
C4	1.5013	2.1977	2.5273		1.5033	2.9600	3.3524	1.0879	2.2426	1.0866	2.2345
C5	1.5013	2.1977	2.5273	1.5033		3.3524	2.9600	2.2426	1.0879	2.2345	1.0866
H6	2.0356	2.5031	1.0171	2.9600	3.3524		1.6475	3.7000	4.2314	3.0138	3.6415
H7	2.0356	2.5031	1.0171	3.3524	2.9600	1.6475		4.2314	3.7000	3.6415	3.0138
H8	2.2339	2.4773	3.4305	1.0879	2.2426	3.7000	4.2314		2.5583	1.8207	3.1308
H9	2.2339	2.4773	3.4305	2.2426	1.0879	4.2314	3.7000	2.5583		3.1308	1.8207
H10	2.2207	3.0916	2.7012	1.0866	2.2345	3.0138	3.6415	1.8207	3.1308		2.5358
H11	2.2207	3.0916	2.7012	2.2345	1.0866	3.6415	3.0138	3.1308	1.8207	2.5358

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H6	110.591	C1	N3	H7	110.591
C1	C4	C5	59.956	C1	C4	H8	118.381
C1	C4	H10	117.304	C1	C5	C4	59.956
C1	C5	H9	118.381	C1	C5	H11	117.304
H2	C1	N3	117.894	H2	C1	C4	114.686
H2	C1	C5	114.686	N3	C1	C4	118.343
N3	C1	C5	118.343	C4	C1	C5	60.087
C4	C5	H9	119.003	C4	C5	H11	118.367
C5	C4	H8	119.003	C5	C4	H10	118.367
H6	N3	H7	108.178	H8	C4	H10	113.703
H9	C5	H11	113.703

All results from a given calculation for C₃H₇N (Cyclopropylamine)

using model chemistry: CCD/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 C3H7N (Cyclopropylamine)

using model chemistry: CCD/6-31G*

States and conformations

All results from a given calculation for C₃H₇N (Cyclopropylamine)