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	hartrees
Energy at 0K	-172.788017
Energy at 298.15K	-172.796498
HF Energy	-172.106578
Nuclear repulsion energy	125.519282

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3552	3355	0.33
2	A'	3324	3139	5.53
3	A'	3216	3038	3.04
4	A'	3161	2985	33.47
5	A'	1675	1582	15.20
6	A'	1524	1439	16.16
7	A'	1433	1354	16.91
8	A'	1265	1195	0.21
9	A'	1196	1130	6.86
10	A'	1068	1008	14.78
11	A'	1041	983	9.48
12	A'	878	830	113.57
13	A'	843	796	25.16
14	A'	782	738	2.65
15	A'	406	384	5.74
16	A"	3648	3445	3.80
17	A"	3313	3129	0.31
18	A"	3211	3033	8.56
19	A"	1469	1387	1.68
20	A"	1288	1216	0.96
21	A"	1211	1144	0.11
22	A"	1150	1086	0.60
23	A"	1079	1019	1.49
24	A"	932	880	8.80
25	A"	854	806	1.69
26	A"	406	383	8.71
27	A"	281	266	31.28

Atom	x (Å)	y (Å)	z (Å)
C1	-0.311	0.411	0.000
H2	-1.266	0.936	0.000
N3	0.891	1.193	0.000
C4	-0.311	-0.887	0.751
C5	-0.311	-0.887	-0.751
H6	0.926	1.786	0.819
H7	0.926	1.786	-0.819
H8	-1.213	-1.174	1.275
H9	-1.213	-1.174	-1.275
H10	0.600	-1.165	1.261
H11	0.600	-1.165	-1.261

	C1	H2	N3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.0900	1.4345	1.5000	1.5000	2.0227	2.0227	2.2253	2.2253	2.2153	2.2153
H2	1.0900		2.1731	2.1911	2.1911	2.4901	2.4901	2.4659	2.4659	3.0809	3.0809
N3	1.4345	2.1731		2.5177	2.5177	1.0111	1.0111	3.4145	3.4145	2.6905	2.6905
C4	1.5000	2.1911	2.5177		1.5026	2.9463	3.3378	1.0818	2.2366	1.0810	2.2269
C5	1.5000	2.1911	2.5177	1.5026		3.3378	2.9463	2.2366	1.0818	2.2269	1.0810
H6	2.0227	2.4901	1.0111	2.9463	3.3378		1.6370	3.6805	4.2097	3.0019	3.6251
H7	2.0227	2.4901	1.0111	3.3378	2.9463	1.6370		4.2097	3.6805	3.6251	3.0019
H8	2.2253	2.4659	3.4145	1.0818	2.2366	3.6805	4.2097		2.5504	1.8138	3.1183
H9	2.2253	2.4659	3.4145	2.2366	1.0818	4.2097	3.6805	2.5504		3.1183	1.8138
H10	2.2153	3.0809	2.6905	1.0810	2.2269	3.0019	3.6251	1.8138	3.1183		2.5227
H11	2.2153	3.0809	2.6905	2.2269	1.0810	3.6251	3.0019	3.1183	1.8138	2.5227

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H6	110.401	C1	N3	H7	110.401
C1	C4	C5	59.945	C1	C4	H8	118.159
C1	C4	H10	117.324	C1	C5	C4	59.945
C1	C5	H9	118.159	C1	C5	H11	117.324
H2	C1	N3	118.173	H2	C1	C4	114.632
H2	C1	C5	114.632	N3	C1	C4	118.160
N3	C1	C5	118.160	C4	C1	C5	60.111
C4	C5	H9	118.965	C4	C5	H11	118.155
C5	C4	H8	118.965	C5	C4	H10	118.155
H6	N3	H7	108.107	H8	C4	H10	113.983
H9	C5	H11	113.983

All results from a given calculation for C₃H₇N (Cyclopropylamine)

using model chemistry: MP2/6-31G(2df,p)

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: MP2/6-31G(2df,p)

States and conformations

All results from a given calculation for C₃H₇N (Cyclopropylamine)