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	hartrees
Energy at 0K	-195.357941
Energy at 298.15K	-195.368074
HF Energy	-195.357941
Nuclear repulsion energy	171.340449

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3173	3005	27.92
2	A	3165	2998	20.13
3	A	3145	2979	18.55
4	A	3138	2973	11.96
5	A	3128	2963	3.54
6	A	3115	2951	5.36
7	A	3093	2930	11.69
8	A	3076	2913	15.08
9	A	3067	2905	18.01
10	A	3044	2883	13.82
11	A	1771	1678	0.60
12	A	1576	1493	10.01
13	A	1571	1488	8.03
14	A	1564	1482	10.78
15	A	1555	1473	5.64
16	A	1545	1463	3.37
17	A	1473	1395	9.57
18	A	1463	1386	6.38
19	A	1454	1377	2.67
20	A	1369	1297	1.00
21	A	1340	1269	0.77
22	A	1318	1248	0.51
23	A	1199	1136	2.21
24	A	1130	1070	5.64
25	A	1106	1048	0.21
26	A	1085	1028	0.37
27	A	1052	996	0.58
28	A	1031	977	2.86
29	A	951	901	11.79
30	A	878	832	2.14
31	A	821	777	4.58
32	A	743	704	45.32
33	A	583	552	7.66
34	A	494	468	2.05
35	A	329	312	0.07
36	A	267	253	0.01
37	A	257	243	0.10
38	A	119	112	0.40
39	A	36	35	0.19

Atom	x (Å)	y (Å)	z (Å)
C1	2.132	-0.330	-0.436
H2	2.613	0.629	-0.658
H3	2.896	-1.024	-0.073
H4	1.709	-0.724	-1.364
C5	1.013	-0.138	0.616
H6	0.548	-1.103	0.837
H7	1.456	0.234	1.548
C8	-2.018	-0.703	-0.058
H9	-2.414	-1.011	-1.033
H10	-1.370	-1.499	0.314
H11	-2.870	-0.606	0.625
C12	-0.012	0.856	0.120
H13	0.374	1.864	-0.024
C14	-1.289	0.616	-0.179
H15	-1.895	1.441	-0.548

	C1	H2	H3	H4	C5	H6	H7	C8	H9	H10	H11	C12	H13	C14	H15
C1		1.0950	1.0943	1.0938	1.5480	2.1741	2.1709	4.1840	4.6353	3.7680	5.1207	2.5128	2.8416	3.5588	4.4009
H2	1.0950		1.7762	1.7735	2.1845	3.0816	2.5226	4.8555	5.3004	4.6193	5.7645	2.7475	2.6346	3.9311	4.5819
H3	1.0943	1.7762		1.7797	2.1920	2.5188	2.5066	4.9244	5.3958	4.3101	5.8228	3.4683	3.8348	4.4961	5.4090
H4	1.0938	1.7735	1.7797		2.1793	2.5172	3.0766	3.9492	4.1459	3.5916	4.9937	2.7683	3.2058	3.4911	4.2828
C5	1.5480	2.1845	2.1920	2.1793		1.0932	1.0975	3.1558	3.9016	2.7609	3.9106	1.5115	2.1973	2.5495	3.5080
H6	2.1741	3.0816	2.5188	2.5172	1.0932		1.7656	2.7473	3.5043	2.0279	3.4605	2.1598	3.0946	2.7136	3.7897
H7	2.1709	2.5226	2.5066	3.0766	1.0975	1.7656		3.9406	4.8157	3.5378	4.5023	2.1407	2.5108	3.2661	4.1336
C8	4.1840	4.8555	4.9244	3.9492	3.1558	2.7473	3.9406		1.0964	1.0915	1.0964	2.5463	3.5086	1.5116	2.2023
H9	4.6353	5.3004	5.3958	4.1459	3.9016	3.5043	4.8157	1.0964		1.7723	1.7671	3.2531	4.1296	2.1543	2.5524
H10	3.7680	4.6193	4.3101	3.5916	2.7609	2.0279	3.5378	1.0915	1.7723		1.7724	2.7251	3.8034	2.1730	3.1081
H11	5.1207	5.7645	5.8228	4.9937	3.9106	3.4605	4.5023	1.0964	1.7671	1.7724		3.2491	4.1284	2.1539	2.5528
C12	2.5128	2.7475	3.4683	2.7683	1.5115	2.1598	2.1407	2.5463	3.2531	2.7251	3.2491		1.0894	1.3332	2.0821
H13	2.8416	2.6346	3.8348	3.2058	2.1973	3.0946	2.5108	3.5086	4.1296	3.8034	4.1284	1.0894		2.0849	2.3669
C14	3.5588	3.9311	4.4961	3.4911	2.5495	2.7136	3.2661	1.5116	2.1543	2.1730	2.1539	1.3332	2.0849		1.0882
H15	4.4009	4.5819	5.4090	4.2828	3.5080	3.7897	4.1336	2.2023	2.5524	3.1081	2.5528	2.0821	2.3669	1.0882

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C5	H6	109.596	C1	C5	H7	109.099
C1	C5	C12	110.425	H2	C1	H3	108.454
H2	C1	H4	108.243	H2	C1	C5	110.304
H3	C1	H4	108.856	H3	C1	C5	110.948
H4	C1	C5	109.971	C5	C12	H13	114.333
C5	C12	C14	127.218	H6	C5	H7	107.399
H6	C5	C12	111.009	H7	C5	C12	109.243
C8	C14	C12	126.924	C8	C14	H15	114.818
H9	C8	H10	108.204	H9	C8	H11	107.382
H9	C8	C14	110.372	H10	C8	H11	108.211
H10	C8	C14	112.177	H11	C8	C14	110.338
C12	C14	H15	118.257	H13	C12	C14	118.423

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

using model chemistry: M06-2X/3-21G*

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	-0.558
2	H	0.193
3	H	0.195
4	H	0.202
5	C	-0.472
6	H	0.206
7	H	0.211
8	C	-0.623
9	H	0.210
10	H	0.206
11	H	0.211
12	C	-0.168
13	H	0.192
14	C	-0.200
15	H	0.196

	x	y	z	Total
	-0.014	-0.194	-0.015	0.195
CHELPG
AIM
ESP

	x	y	z
x	9.860	0.391	0.713
y	0.391	6.746	-0.189
z	0.713	-0.189	5.484

<r²>	162.422
(<r²>)^1/2	12.744

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

using model chemistry: M06-2X/3-21G*

States and conformations

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