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	hartrees
Energy at 0K	-35.184359
Energy at 298.15K	-35.189562
HF Energy	-34.505512
Nuclear repulsion energy	76.443748

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3296	3140	6.88
2	A'	3227	3075	1.15
3	A'	3183	3033	3.30
4	A'	2141	2040	4.00
5	A'	1535	1463	0.95
6	A'	1391	1325	0.32
7	A'	1228	1170	1.22
8	A'	1146	1092	0.76
9	A'	1095	1043	9.62
10	A'	965	920	24.74
11	A'	818	779	1.64
12	A'	761	725	4.23
13	A'	508	484	1.08
14	A'	197	187	2.87
15	A"	3283	3128	0.26
16	A"	3178	3028	9.29
17	A"	1498	1427	3.02
18	A"	1219	1162	0.80
19	A"	1140	1086	5.29
20	A"	1096	1044	5.68
21	A"	920	877	1.39
22	A"	844	804	11.12
23	A"	524	499	0.09
24	A"	208	198	1.59

Atom	x (Å)	y (Å)	z (Å)
H1	-1.821	0.873	1.272
H2	-1.821	0.873	-1.272
H3	-1.128	-0.830	-1.263
H4	-1.128	-0.830	1.263
H5	0.189	1.702	0.000
C6	0.000	0.632	0.000
N7	2.151	-0.902	0.000
C8	1.192	-0.200	0.000
C9	-1.227	0.125	0.757
C10	-1.227	0.125	-0.757

	H1	H2	H3	H4	H5	C6	N7	C8	C9	C10
H1		2.5441	3.1319	1.8389	2.5194	2.2346	4.5329	3.4428	1.0856	2.2426
H2	2.5441		1.8389	3.1319	2.5194	2.2346	4.5329	3.4428	2.2426	1.0856
H3	3.1319	1.8389		2.5264	3.1208	2.2374	3.5142	2.7157	2.2365	1.0854
H4	1.8389	3.1319	2.5264		3.1208	2.2374	3.5142	2.7157	1.0854	2.2365
H5	2.5194	2.5194	3.1208	3.1208		1.0859	3.2600	2.1502	2.2506	2.2506
C6	2.2346	2.2346	2.2374	2.2374	1.0859		2.6421	1.4543	1.5284	1.5284
N7	4.5329	4.5329	3.5142	3.5142	3.2600	2.6421		1.1880	3.6107	3.6107
C8	3.4428	3.4428	2.7157	2.7157	2.1502	1.4543	1.1880		2.5558	2.5558
C9	1.0856	2.2426	2.2365	1.0854	2.2506	1.5284	3.6107	2.5558		1.5136
C10	2.2426	1.0856	1.0854	2.2365	2.2506	1.5284	3.6107	2.5558	1.5136

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C9	H4	115.783	H1	C9	C6	116.467
H1	C9	C10	118.337	H2	C10	H3	115.783
H2	C10	C6	116.467	H2	C10	C9	118.337
H3	C10	C6	116.724	H3	C10	C9	117.812
H4	C9	C6	116.724	H4	C9	C10	117.812
H5	C6	C8	114.887	H5	C6	C9	117.832
H5	C6	C10	117.832	C6	C8	N7	178.703
C6	C9	C10	60.320	C6	C10	C9	60.320
C8	C6	C9	117.915	C8	C6	C10	117.915
C9	C6	C10	59.360

All results from a given calculation for C₄H₅N (Cyclopropanecarbonitrile)

using model chemistry: MP2/CEP-121G*

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/CEP-121G*

States and conformations

All results from a given calculation for C₄H₅N (Cyclopropanecarbonitrile)