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	hartrees
Energy at 0K	-209.533919
Energy at 298.15K	-209.539195
HF Energy	-208.829375
Nuclear repulsion energy	147.290401

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3298	3134	3.95
2	A'	3225	3065	0.60
3	A'	3192	3033	2.09
4	A'	2200	2091	3.37
5	A'	1539	1462	1.13
6	A'	1408	1338	0.54
7	A'	1243	1181	1.14
8	A'	1156	1099	0.69
9	A'	1088	1034	10.36
10	A'	985	936	24.35
11	A'	829	788	1.55
12	A'	771	732	3.86
13	A'	526	499	0.65
14	A'	208	198	3.36
15	A"	3285	3122	0.27
16	A"	3187	3029	6.19
17	A"	1500	1426	5.91
18	A"	1224	1163	0.86
19	A"	1135	1079	4.66
20	A"	1097	1043	6.90
21	A"	924	878	0.57
22	A"	851	809	10.74
23	A"	542	515	0.40
24	A"	215	204	1.83

Atom	x (Å)	y (Å)	z (Å)
H1	0.326	2.032	1.270
H2	0.326	2.032	-1.270
H3	-1.122	0.912	-1.260
H4	-1.122	0.912	1.260
H5	1.660	0.349	0.000
C6	0.583	0.223	0.000
N7	-0.232	-2.261	0.000
C8	0.141	-1.148	0.000
C9	-0.232	1.262	0.750
C10	-0.232	1.262	-0.750

	H1	H2	H3	H4	H5	C6	N7	C8	C9	C10
H1		2.5399	3.1223	1.8298	2.4946	2.2252	4.5112	3.4287	1.0837	2.2320
H2	2.5399		1.8298	3.1223	2.4946	2.2252	4.5112	3.4287	2.2320	1.0837
H3	3.1223	1.8298		2.5201	3.1052	2.2290	3.5284	2.7251	2.2253	1.0836
H4	1.8298	3.1223	2.5201		3.1052	2.2290	3.5284	2.7251	1.0836	2.2253
H5	2.4946	2.4946	3.1052	3.1052		1.0846	3.2239	2.1328	2.2306	2.2306
C6	2.2252	2.2252	2.2290	2.2290	1.0846		2.6140	1.4399	1.5187	1.5187
N7	4.5112	4.5112	3.5284	3.5284	3.2239	2.6140		1.1741	3.6020	3.6020
C8	3.4287	3.4287	2.7251	2.7251	2.1328	1.4399	1.1741		2.5512	2.5512
C9	1.0837	2.2320	2.2253	1.0836	2.2306	1.5187	3.6020	2.5512		1.4991
C10	2.2320	1.0837	1.0836	2.2253	2.2306	1.5187	3.6020	2.5512	1.4991

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C9	H4	115.193	H1	C9	C6	116.535
H1	C9	C10	118.699	H2	C10	H3	115.193
H2	C10	C6	116.535	H2	C10	C9	118.699
H3	C10	C6	116.880	H3	C10	C9	118.105
H4	C9	C6	116.880	H4	C9	C10	118.105
H5	C6	C8	114.574	H5	C6	C9	116.938
H5	C6	C10	116.938	C6	C8	N7	179.345
C6	C9	C10	60.425	C6	C10	C9	60.425
C8	C6	C9	119.128	C8	C6	C10	119.128
C9	C6	C10	59.149

All results from a given calculation for C₄H₅N (Cyclopropanecarbonitrile)

using model chemistry: MP2/6-311G*

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 C4H5N (Cyclopropanecarbonitrile)

using model chemistry: MP2/6-311G*

States and conformations

All results from a given calculation for C₄H₅N (Cyclopropanecarbonitrile)