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	hartrees
Energy at 0K	-196.410790
Energy at 298.15K	-196.420783
Nuclear repulsion energy	171.486536

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3188	3027	60.40
2	A	3171	3010	9.65
3	A	3163	3002	39.56
4	A	3159	2999	22.37
5	A	3154	2994	18.50
6	A	3128	2969	5.17
7	A	3120	2962	21.49
8	A	3077	2921	32.19
9	A	3066	2910	27.75
10	A	3058	2903	29.41
11	A	1779	1689	2.12
12	A	1536	1459	5.22
13	A	1527	1450	6.65
14	A	1520	1443	4.50
15	A	1512	1436	5.90
16	A	1509	1432	0.84
17	A	1461	1387	7.83
18	A	1433	1361	1.40
19	A	1423	1351	2.34
20	A	1351	1282	7.32
21	A	1315	1249	0.20
22	A	1292	1227	0.22
23	A	1185	1125	0.62
24	A	1106	1050	3.47
25	A	1073	1019	0.50
26	A	1058	1004	2.95
27	A	1054	1000	0.32
28	A	1019	967	0.30
29	A	957	909	11.48
30	A	881	837	1.71
31	A	798	757	3.41
32	A	728	691	30.64
33	A	569	540	7.08
34	A	472	448	1.35
35	A	294	279	0.04
36	A	255	242	0.02
37	A	212	202	0.00
38	A	138	131	0.37
39	A	54	51	0.13

Atom	x (Å)	y (Å)	z (Å)
C1	2.184	-0.280	-0.410
H2	2.666	0.693	-0.535
H3	2.942	-0.985	-0.057
H4	1.845	-0.610	-1.396
C5	1.013	-0.193	0.567
H6	0.564	-1.181	0.692
H7	1.398	0.094	1.554
C8	-2.064	-0.669	-0.083
H9	-2.511	-0.901	-1.056
H10	-1.449	-1.520	0.212
H11	-2.893	-0.593	0.629
C12	-0.009	0.813	0.135
H13	0.373	1.827	0.028
C14	-1.298	0.613	-0.144
H15	-1.881	1.479	-0.454

	C1	H2	H3	H4	C5	H6	H7	C8	H9	H10	H11	C12	H13	C14	H15
C1		1.0938	1.0930	1.0926	1.5279	2.1563	2.1485	4.2784	4.7793	3.8886	5.1915	2.5102	2.8133	3.6045	4.4289
H2	1.0938		1.7664	1.7640	2.1755	3.0719	2.5163	4.9431	5.4415	4.7316	5.8232	2.7601	2.6192	3.9839	4.6142
H3	1.0930	1.7664		1.7700	2.1767	2.5008	2.4783	5.0161	5.5439	4.4315	5.8879	3.4604	3.8095	4.5316	5.4294
H4	1.0926	1.7640	1.7700		2.1726	2.5151	3.0652	4.1247	4.3792	3.7772	5.1529	2.7940	3.1838	3.5977	4.3741
C5	1.5279	2.1755	2.1767	2.1726		1.0926	1.0974	3.1810	3.9436	2.8191	3.9266	1.4971	2.1863	2.5485	3.4937
H6	2.1563	3.0719	2.5008	2.5151	1.0926		1.7505	2.7874	3.5477	2.0967	3.5068	2.1476	3.0864	2.7172	3.7894
H7	2.1485	2.5163	2.4783	3.0652	1.0974	1.7505		3.9051	4.8042	3.5368	4.4428	2.1236	2.5265	3.2284	4.0861
C8	4.2784	4.9431	5.0161	4.1247	3.1810	2.7874	3.9051		1.0953	1.0906	1.0954	2.5431	3.4906	1.4946	2.1873
H9	4.7793	5.4415	5.5439	4.3792	3.9436	3.5477	4.8042	1.0953		1.7660	1.7553	3.2579	4.1152	2.1432	2.5345
H10	3.8886	4.7316	4.4315	3.7772	2.8191	2.0967	3.5368	1.0906	1.7660		1.7653	2.7421	3.8151	2.1673	3.1016
H11	5.1915	5.8232	5.8879	5.1529	3.9266	3.5068	4.4428	1.0954	1.7553	1.7653		3.2460	4.1091	2.1439	2.5477
C12	2.5102	2.7601	3.4604	2.7940	1.4971	2.1476	2.1236	2.5431	3.2579	2.7421	3.2460		1.0894	1.3340	2.0718
H13	2.8133	2.6192	3.8095	3.1838	2.1863	3.0864	2.5265	3.4906	4.1152	3.8151	4.1091	1.0894		2.0730	2.3305
C14	3.6045	3.9839	4.5316	3.5977	2.5485	2.7172	3.2284	1.4946	2.1432	2.1673	2.1439	1.3340	2.0730		1.0884
H15	4.4289	4.6142	5.4294	4.3741	3.4937	3.7894	4.0861	2.1873	2.5345	3.1016	2.5477	2.0718	2.3305	1.0884

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C5	H6	109.624	C1	C5	H7	108.739
C1	C5	C12	112.155	H2	C1	H3	107.758
H2	C1	H4	107.572	H2	C1	C5	111.075
H3	C1	H4	108.159	H3	C1	C5	111.214
H4	C1	C5	110.910	C5	C12	H13	114.476
C5	C12	C14	128.271	H6	C5	H7	106.130
H6	C5	C12	111.087	H7	C5	C12	108.896
C8	C14	C12	127.973	C8	C14	H15	114.815
H9	C8	H10	107.789	H9	C8	H11	106.508
H9	C8	C14	110.747	H10	C8	H11	107.724
H10	C8	C14	113.000	H11	C8	C14	110.793
C12	C14	H15	117.212	H13	C12	C14	117.247

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	-0.488
2	H	0.161
3	H	0.161
4	H	0.168
5	C	-0.347
6	H	0.160
7	H	0.165
8	C	-0.535
9	H	0.172
10	H	0.170
11	H	0.173
12	C	-0.115
13	H	0.140
14	C	-0.130
15	H	0.143

	x	y	z	Total
	-0.025	-0.193	0.033	0.197
CHELPG
AIM
ESP

	x	y	z
x	10.641	0.314	0.672
y	0.314	7.276	-0.169
z	0.672	-0.169	5.969

<r²>	164.518
(<r²>)^1/2	12.826

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)-)