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	hartrees
Energy at 0K	-172.594457
Energy at 298.15K	-172.603072
HF Energy	-172.081986
Nuclear repulsion energy	125.656850

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3604	3337	0.50
2	A	3351	3102	18.90
3	A	3261	3019	6.79
4	A	3197	2960	48.40
5	A	1765	1634	20.88
6	A	1610	1491	15.26
7	A	1503	1392	17.55
8	A	1314	1216	0.26
9	A	1248	1155	11.41
10	A	1143	1059	12.68
11	A	1075	995	7.34
12	A	927	858	140.55
13	A	868	804	26.24
14	A	818	758	2.61
15	A	429	397	7.18
16	A	3690	3416	0.56
17	A	3339	3091	0.22
18	A	3253	3011	18.38
19	A	1543	1429	1.40
20	A	1345	1245	1.68
21	A	1267	1173	0.09
22	A	1206	1116	0.36
23	A	1152	1067	1.13
24	A	970	898	11.82
25	A	895	828	2.83
26	A	419	388	10.12
27	A	299	277	41.08

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.527	0.000
H2	-0.405	1.536	0.000
N3	1.431	0.369	0.000
C4	-0.789	-0.499	0.751
C5	-0.789	-0.499	-0.751
H6	1.833	0.815	0.814
H7	1.833	0.815	-0.814
H8	-1.685	-0.185	1.267
H9	-1.685	-0.185	-1.267
H10	-0.222	-1.274	1.247
H11	-0.222	-1.274	-1.247

	C1	H2	N3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.0877	1.4393	1.4960	1.4960	2.0267	2.0267	2.2254	2.2254	2.2011	2.2011
H2	1.0877		2.1752	2.2033	2.2033	2.4888	2.4888	2.4918	2.4918	3.0795	3.0795
N3	1.4393	2.1752		2.4985	2.4985	1.0120	1.0120	3.4088	3.4088	2.6425	2.6425
C4	1.4960	2.2033	2.4985		1.5012	2.9335	3.3243	1.0811	2.2303	1.0802	2.2159
C5	1.4960	2.2033	2.4985	1.5012		3.3243	2.9335	2.2303	1.0811	2.2159	1.0802
H6	2.0267	2.4888	1.0120	2.9335	3.3243		1.6288	3.6856	4.2086	2.9616	3.5823
H7	2.0267	2.4888	1.0120	3.3243	2.9335	1.6288		4.2086	3.6856	3.5823	2.9616
H8	2.2254	2.4918	3.4088	1.0811	2.2303	3.6856	4.2086		2.5348	1.8234	3.1057
H9	2.2254	2.4918	3.4088	2.2303	1.0811	4.2086	3.6856	2.5348		3.1057	1.8234
H10	2.2011	3.0795	2.6425	1.0802	2.2159	2.9616	3.5823	1.8234	3.1057		2.4936
H11	2.2011	3.0795	2.6425	2.2159	1.0802	3.5823	2.9616	3.1057	1.8234	2.4936

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H6	110.325	C1	N3	H7	110.325
C1	C4	C5	59.885	C1	C4	H8	118.536
C1	C4	H10	116.452	C1	C5	C4	59.885
C1	C5	H9	118.536	C1	C5	H11	116.452
H2	C1	N3	118.146	H2	C1	C4	116.127
H2	C1	C5	116.127	N3	C1	C4	116.664
N3	C1	C5	116.664	C4	C1	C5	60.230
C4	C5	H9	118.555	C4	C5	H11	117.343
C5	C4	H8	118.555	C5	C4	H10	117.343
H6	N3	H7	107.176	H8	C4	H10	115.055
H9	C5	H11	115.055

All results from a given calculation for C₃H₇N (Cyclopropylamine)

using model chemistry: CISD/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: CISD/6-31G*

States and conformations

All results from a given calculation for C₃H₇N (Cyclopropylamine)