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	hartrees
Energy at 0K	-196.424155
Energy at 298.15K	-196.434128
Nuclear repulsion energy	171.421995

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3176	3032	57.63
2	A	3158	3016	9.72
3	A	3151	3009	36.08
4	A	3147	3005	25.88
5	A	3142	3000	14.11
6	A	3115	2974	5.50
7	A	3109	2968	20.67
8	A	3062	2924	32.02
9	A	3052	2914	27.29
10	A	3045	2908	28.74
11	A	1767	1687	2.31
12	A	1514	1446	4.63
13	A	1505	1437	6.20
14	A	1496	1428	4.44
15	A	1489	1421	5.42
16	A	1485	1418	0.58
17	A	1444	1378	7.95
18	A	1413	1349	1.17
19	A	1402	1338	2.16
20	A	1333	1273	7.09
21	A	1301	1242	0.19
22	A	1278	1220	0.22
23	A	1172	1119	0.50
24	A	1094	1044	3.43
25	A	1059	1012	0.58
26	A	1049	1002	3.15
27	A	1043	995	0.14
28	A	1012	967	0.31
29	A	949	906	11.91
30	A	875	835	1.82
31	A	790	755	3.46
32	A	723	690	29.05
33	A	566	541	7.16
34	A	469	448	1.32
35	A	291	278	0.04
36	A	253	241	0.02
37	A	210	201	0.00
38	A	137	131	0.39
39	A	53	51	0.14

Atom	x (Å)	y (Å)	z (Å)
C1	2.186	-0.280	-0.409
H2	2.668	0.694	-0.532
H3	2.944	-0.984	-0.056
H4	1.851	-0.608	-1.396
C5	1.012	-0.193	0.566
H6	0.562	-1.181	0.689
H7	1.395	0.092	1.554
C8	-2.065	-0.670	-0.084
H9	-2.512	-0.901	-1.056
H10	-1.448	-1.520	0.210
H11	-2.893	-0.596	0.629
C12	-0.010	0.813	0.135
H13	0.371	1.829	0.029
C14	-1.300	0.613	-0.144
H15	-1.882	1.480	-0.452

	C1	H2	H3	H4	C5	H6	H7	C8	H9	H10	H11	C12	H13	C14	H15
C1		1.0936	1.0928	1.0925	1.5288	2.1577	2.1494	4.2813	4.7834	3.8901	5.1937	2.5129	2.8167	3.6086	4.4333
H2	1.0936		1.7658	1.7633	2.1763	3.0730	2.5175	4.9461	5.4459	4.7330	5.8257	2.7628	2.6232	3.9882	4.6190
H3	1.0928	1.7658		1.7694	2.1779	2.5029	2.4796	5.0183	5.5475	4.4327	5.8892	3.4627	3.8128	4.5351	5.4331
H4	1.0925	1.7633	1.7694		2.1736	2.5170	3.0660	4.1301	4.3862	3.7810	5.1578	2.7975	3.1872	3.6036	4.3805
C5	1.5288	2.1763	2.1779	2.1736		1.0927	1.0975	3.1807	3.9439	2.8183	3.9261	1.4977	2.1879	2.5495	3.4947
H6	2.1577	3.0730	2.5029	2.5170	1.0927		1.7501	2.7857	3.5465	2.0947	3.5047	2.1477	3.0874	2.7169	3.7894
H7	2.1494	2.5175	2.4796	3.0660	1.0975	1.7501		3.9030	4.8028	3.5343	4.4399	2.1234	2.5282	3.2279	4.0856
C8	4.2813	4.9461	5.0183	4.1301	3.1807	2.7857	3.9030		1.0951	1.0904	1.0952	2.5437	3.4914	1.4949	2.1887
H9	4.7834	5.4459	5.5475	4.3862	3.9439	3.5465	4.8028	1.0951		1.7658	1.7546	3.2588	4.1162	2.1434	2.5359
H10	3.8901	4.7330	4.4327	3.7810	2.8183	2.0947	3.5343	1.0904	1.7658		1.7652	2.7424	3.8156	2.1676	3.1027
H11	5.1937	5.8257	5.8892	5.1578	3.9261	3.5047	4.4399	1.0952	1.7546	1.7652		3.2467	4.1100	2.1441	2.5493
C12	2.5129	2.7628	3.4627	2.7975	1.4977	2.1477	2.1234	2.5437	3.2588	2.7424	3.2467		1.0897	1.3350	2.0724
H13	2.8167	2.6232	3.8128	3.1872	2.1879	3.0874	2.5282	3.4914	4.1162	3.8156	4.1100	1.0897		2.0737	2.3305
C14	3.6086	3.9882	4.5351	3.6036	2.5495	2.7169	3.2279	1.4949	2.1434	2.1676	2.1441	1.3350	2.0737		1.0887
H15	4.4333	4.6190	5.4331	4.3805	3.4947	3.7894	4.0856	2.1887	2.5359	3.1027	2.5493	2.0724	2.3305	1.0887

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C5	H6	109.667	C1	C5	H7	108.738
C1	C5	C12	112.254	H2	C1	H3	107.735
H2	C1	H4	107.531	H2	C1	C5	111.084
H3	C1	H4	108.136	H3	C1	C5	111.262
H4	C1	C5	110.935	C5	C12	H13	114.554
C5	C12	C14	128.228	H6	C5	H7	106.081
H6	C5	C12	111.049	H7	C5	C12	108.833
C8	C14	C12	127.928	C8	C14	H15	114.900
H9	C8	H10	107.797	H9	C8	H11	106.465
H9	C8	C14	110.751	H10	C8	H11	107.732
H10	C8	C14	113.014	H11	C8	C14	110.799
C12	C14	H15	117.171	H13	C12	C14	117.212

All results from a given calculation for C₅H₁₀ (2-Pentene, (Z)-)

using model chemistry: B1B95/6-31G**

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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Number	Element	Mulliken
1	C	-0.360
2	H	0.120
3	H	0.118
4	H	0.128
5	C	-0.259
6	H	0.115
7	H	0.126
8	C	-0.396
9	H	0.131
10	H	0.123
11	H	0.132
12	C	-0.077
13	H	0.096
14	C	-0.098
15	H	0.100

	x	y	z	Total
	-0.024	-0.211	0.033	0.215
CHELPG
AIM
ESP

	x	y	z
x	10.815	0.315	0.664
y	0.315	7.408	-0.170
z	0.664	-0.170	6.082

<r²>	164.659
(<r²>)^1/2	12.832

All results from a given calculation for C5H10 (2-Pentene, (Z)-)

using model chemistry: B1B95/6-31G**

States and conformations

All results from a given calculation for C₅H₁₀ (2-Pentene, (Z)-)