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	hartrees
Energy at 0K	-195.142286
Energy at 298.15K	-195.152613
HF Energy	-195.142286
Nuclear repulsion energy	171.567906

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3331	2993	70.76
2	A	3303	2968	22.35
3	A	3298	2963	26.51
4	A	3272	2940	57.03
5	A	3266	2934	50.15
6	A	3250	2920	7.56
7	A	3238	2909	39.17
8	A	3201	2876	30.66
9	A	3196	2872	46.74
10	A	3190	2866	44.28
11	A	1903	1710	1.42
12	A	1653	1485	4.35
13	A	1643	1476	4.48
14	A	1641	1475	1.75
15	A	1632	1466	3.52
16	A	1630	1464	2.41
17	A	1585	1424	2.63
18	A	1561	1402	0.92
19	A	1553	1396	2.62
20	A	1475	1325	12.71
21	A	1420	1275	0.04
22	A	1397	1255	0.10
23	A	1278	1148	0.19
24	A	1199	1077	4.65
25	A	1181	1061	2.84
26	A	1144	1028	0.02
27	A	1127	1013	0.52
28	A	1098	986	2.02
29	A	1002	901	6.62
30	A	923	829	1.28
31	A	860	773	5.60
32	A	793	712	28.47
33	A	608	547	5.09
34	A	511	459	1.03
35	A	325	292	0.03
36	A	282	253	0.03
37	A	235	211	0.01
38	A	134	120	0.21
39	A	58	52	0.06

Atom	x (Å)	y (Å)	z (Å)
C1	2.188	-0.283	-0.412
H2	2.662	0.684	-0.549
H3	2.942	-0.974	-0.052
H4	1.851	-0.626	-1.384
C5	1.018	-0.189	0.572
H6	0.583	-1.171	0.708
H7	1.402	0.111	1.545
C8	-2.072	-0.671	-0.083
H9	-2.513	-0.895	-1.050
H10	-1.473	-1.521	0.212
H11	-2.894	-0.584	0.623
C12	-0.016	0.811	0.130
H13	0.354	1.818	0.021
C14	-1.292	0.612	-0.144
H15	-1.865	1.471	-0.451

	C1	H2	H3	H4	C5	H6	H7	C8	H9	H10	H11	C12	H13	C14	H15
C1		1.0854	1.0847	1.0845	1.5312	2.1486	2.1446	4.2899	4.7828	3.9143	5.1944	2.5193	2.8217	3.6025	4.4160
H2	1.0854		1.7531	1.7523	2.1727	3.0561	2.5094	4.9461	5.4334	4.7473	5.8179	2.7660	2.6340	3.9751	4.5959
H3	1.0847	1.7531		1.7567	2.1699	2.4863	2.4697	5.0234	5.5460	4.4567	5.8878	3.4601	3.8077	4.5221	5.4079
H4	1.0845	1.7523	1.7567		2.1700	2.5057	3.0528	4.1331	4.3844	3.7940	5.1516	2.8001	3.1914	3.5979	4.3674
C5	1.5312	2.1727	2.1699	2.1700		1.0822	1.0880	3.1950	3.9489	2.8474	3.9319	1.5049	2.1845	2.5471	3.4802
H6	2.1486	3.0561	2.4863	2.5057	1.0822		1.7361	2.8150	3.5708	2.1438	3.5270	2.1494	3.0750	2.7235	3.7834
H7	2.1446	2.5094	2.4697	3.0528	1.0880	1.7361		3.9151	4.8031	3.5644	4.4482	2.1220	2.5163	3.2182	4.0622
C8	4.2899	4.9461	5.0234	4.1331	3.1950	2.8150	3.9151		1.0865	1.0807	1.0866	2.5428	3.4771	1.5027	2.1834
H9	4.7828	5.4334	5.5460	4.3844	3.9489	3.5708	4.8031	1.0865		1.7509	1.7439	3.2454	4.0895	2.1407	2.5254
H10	3.9143	4.7473	4.4567	3.7940	2.8474	2.1438	3.5644	1.0807	1.7509		1.7507	2.7504	3.8107	2.1697	3.0895
H11	5.1944	5.8179	5.8878	5.1516	3.9319	3.5270	4.4482	1.0866	1.7439	1.7507		3.2355	4.0842	2.1412	2.5369
C12	2.5193	2.7660	3.4601	2.8001	1.5049	2.1494	2.1220	2.5428	3.2454	2.7504	3.2355		1.0786	1.3194	2.0468
H13	2.8217	2.6340	3.8077	3.1914	2.1845	3.0750	2.5163	3.4771	4.0895	3.8107	4.0842	1.0786		2.0470	2.2947
C14	3.6025	3.9751	4.5221	3.5979	2.5471	2.7235	3.2182	1.5027	2.1407	2.1697	2.1412	1.3194	2.0470		1.0776
H15	4.4160	4.5959	5.4079	4.3674	3.4802	3.7834	4.0622	2.1834	2.5254	3.0895	2.5369	2.0468	2.2947	1.0776

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C5	H6	109.396	C1	C5	H7	108.750
C1	C5	C12	112.148	H2	C1	H3	107.774
H2	C1	H4	107.719	H2	C1	C5	111.129
H3	C1	H4	108.161	H3	C1	C5	110.949
H4	C1	C5	110.966	C5	C12	H13	114.452
C5	C12	C14	128.683	H6	C5	H7	106.254
H6	C5	C12	111.311	H7	C5	C12	108.778
C8	C14	C12	128.478	C8	C14	H15	114.598
H9	C8	H10	107.784	H9	C8	H11	106.736
H9	C8	C14	110.510	H10	C8	H11	107.761
H10	C8	C14	113.241	H11	C8	C14	110.543
C12	C14	H15	116.924	H13	C12	C14	116.864

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

using model chemistry: HF/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	-0.477
2	H	0.157
3	H	0.160
4	H	0.165
5	C	-0.343
6	H	0.168
7	H	0.166
8	C	-0.514
9	H	0.169
10	H	0.171
11	H	0.170
12	C	-0.163
13	H	0.170
14	C	-0.170
15	H	0.170

	x	y	z	Total
	-0.018	-0.157	0.036	0.162
CHELPG	-0.039	-0.167	0.025	0.174
AIM
ESP	-0.036	-0.184	0.018	0.189

	x	y	z
x	10.321	0.358	0.710
y	0.358	6.947	-0.141
z	0.710	-0.141	5.831

<r²>	165.216
(<r²>)^1/2	12.854

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

using model chemistry: HF/6-31G*

States and conformations

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