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	hartrees
Energy at 0K	-172.937968
Energy at 298.15K	-172.946448
HF Energy	-172.149535
Nuclear repulsion energy	126.093664

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3545	3366	0.00
2	A'	3300	3133	7.48
3	A'	3212	3049	3.56
4	A'	3158	2998	34.46
5	A'	1662	1578	15.13
6	A'	1528	1450	17.62
7	A'	1436	1364	18.65
8	A'	1270	1206	0.68
9	A'	1197	1137	4.56
10	A'	1053	1000	13.81
11	A'	1034	982	9.60
12	A'	865	821	72.40
13	A'	831	789	71.65
14	A'	784	744	3.33
15	A'	411	390	5.30
16	A"	3635	3451	3.86
17	A"	3288	3122	0.27
18	A"	3205	3043	11.56
19	A"	1474	1400	2.69
20	A"	1279	1214	0.86
21	A"	1210	1149	0.25
22	A"	1149	1091	0.81
23	A"	1070	1015	1.81
24	A"	926	879	11.01
25	A"	857	814	2.98
26	A"	406	386	6.68
27	A"	272	259	29.46

Atom	x (Å)	y (Å)	z (Å)
C1	-0.310	0.408	0.000
H2	-1.259	0.930	0.000
N3	0.887	1.190	0.000
C4	-0.310	-0.884	0.749
C5	-0.310	-0.884	-0.749
H6	0.927	1.778	0.818
H7	0.927	1.778	-0.818
H8	-1.208	-1.170	1.268
H9	-1.208	-1.170	-1.268
H10	0.597	-1.160	1.255
H11	0.597	-1.160	-1.255

	C1	H2	N3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.0824	1.4297	1.4934	1.4934	2.0183	2.0183	2.2147	2.2147	2.2041	2.2041
H2	1.0824		2.1616	2.1792	2.1792	2.4829	2.4829	2.4534	2.4534	3.0637	3.0637
N3	1.4297	2.1616		2.5088	2.5088	1.0077	1.0077	3.4007	3.4007	2.6796	2.6796
C4	1.4934	2.1792	2.5088		1.4972	2.9358	3.3267	1.0758	2.2261	1.0753	2.2169
C5	1.4934	2.1792	2.5088	1.4972		3.3267	2.9358	2.2261	1.0758	2.2169	1.0753
H6	2.0183	2.4829	1.0077	2.9358	3.3267		1.6350	3.6671	4.1947	2.9881	3.6102
H7	2.0183	2.4829	1.0077	3.3267	2.9358	1.6350		4.1947	3.6671	3.6102	2.9881
H8	2.2147	2.4534	3.4007	1.0758	2.2261	3.6671	4.1947		2.5369	1.8051	3.1026
H9	2.2147	2.4534	3.4007	2.2261	1.0758	4.1947	3.6671	2.5369		3.1026	1.8051
H10	2.2041	3.0637	2.6796	1.0753	2.2169	2.9881	3.6102	1.8051	3.1026		2.5102
H11	2.2041	3.0637	2.6796	2.2169	1.0753	3.6102	2.9881	3.1026	1.8051	2.5102

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H6	110.606	C1	N3	H7	110.606
C1	C4	C5	59.917	C1	C4	H8	118.180
C1	C4	H10	117.265	C1	C5	C4	59.917
C1	C5	H9	118.180	C1	C5	H11	117.265
H2	C1	N3	118.075	H2	C1	C4	114.626
H2	C1	C5	114.626	N3	C1	C4	118.230
N3	C1	C5	118.230	C4	C1	C5	60.166
C4	C5	H9	118.898	C4	C5	H11	118.101
C5	C4	H8	118.898	C5	C4	H10	118.101
H6	N3	H7	108.441	H8	C4	H10	114.091
H9	C5	H11	114.091

All results from a given calculation for C₃H₇N (Cyclopropylamine)

using model chemistry: MP2=FULL/cc-pVTZ

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=FULL/cc-pVTZ

States and conformations

All results from a given calculation for C₃H₇N (Cyclopropylamine)